diff --git a/inst/cached/pubchem_inchikey_mtox_cache.rds b/inst/cached/pubchem_inchikey_mtox_cache.rds new file mode 100644 index 0000000..10c949e Binary files /dev/null and b/inst/cached/pubchem_inchikey_mtox_cache.rds differ diff --git a/inst/cached/pubchem_inchikey_mtox_cache2.rds b/inst/cached/pubchem_inchikey_mtox_cache2.rds new file mode 100644 index 0000000..e107feb Binary files /dev/null and b/inst/cached/pubchem_inchikey_mtox_cache2.rds differ diff --git a/inst/cached/pubchem_inchikey_mtox_cache3.rds b/inst/cached/pubchem_inchikey_mtox_cache3.rds new file mode 100644 index 0000000..e862157 Binary files /dev/null and b/inst/cached/pubchem_inchikey_mtox_cache3.rds differ diff --git a/inst/extdata/daphnia/HILIC_POS_EL_CD.xlsx b/inst/extdata/daphnia/HILIC_POS_EL_CD.xlsx deleted file mode 100644 index 211389f..0000000 Binary files a/inst/extdata/daphnia/HILIC_POS_EL_CD.xlsx and /dev/null differ diff --git a/inst/extdata/daphnia/HILIC_POS_EL_CD_comp.xlsx b/inst/extdata/daphnia/HILIC_POS_EL_CD_comp.xlsx deleted file mode 100644 index 8819bbe..0000000 Binary files a/inst/extdata/daphnia/HILIC_POS_EL_CD_comp.xlsx and /dev/null differ diff --git a/inst/extdata/daphnia/HILIC_POS_EL_LS.txt b/inst/extdata/daphnia/HILIC_POS_EL_LS.txt deleted file mode 100644 index 80f838e..0000000 --- a/inst/extdata/daphnia/HILIC_POS_EL_LS.txt +++ /dev/null @@ -1,172 +0,0 @@ -#[c-1]:QC33_MSMS_EL_500_1050_pp.raw -#[c-10]:QC24_MSMS_IL_150_220_pp.raw -#[c-11]:QC23_MSMS_IL_115_185_pp.raw -#[c-12]:QC22_MSMS_IL_70_140_pp.raw -#[c-2]:QC32_MSMS_EL_300_510_pp.raw -#[c-3]:QC31_MSMS_EL_200_310_pp.raw -#[c-4]:QC30_MSMS_EL_150_220_pp.raw -#[c-5]:QC29_MSMS_EL_115_185_pp.raw -#[c-6]:QC28_MSMS_EL_70_140_pp.raw -#[c-7]:QC27_MSMS_IL_500_1050_pp.raw -#[c-8]:QC26_MSMS_IL_300_510_pp.raw -#[c-9]:QC25_MSMS_IL_200_310_pp.raw -#normalize base: -#control group:c -#toprank filter:true -#mScoreThreshold:5.0 -#cScoreThreshold:2.0 - -Rej. LipidIon LipidGroup Class FattyAcid FA1 FA2 FA3 CalcMz IonFormula GroupArea[c] GroupHeight[c] GroupTopPos[c] AreaRSD[c] HeightRSD[c] GroupPQ[c] GroupS/N[c] Area[c-1] Area[c-2] Area[c-3] Area[c-4] Area[c-5] Area[c-6] Area[c-7] Area[c-8] Area[c-9] Area[c-10] Area[c-11] Area[c-12] Height[c-1] Height[c-2] Height[c-3] Height[c-4] Height[c-5] Height[c-6] Height[c-7] Height[c-8] Height[c-9] Height[c-10] Height[c-11] Height[c-12] NormArea[c-1] NormArea[c-2] NormArea[c-3] NormArea[c-4] NormArea[c-5] NormArea[c-6] NormArea[c-7] NormArea[c-8] NormArea[c-9] NormArea[c-10] NormArea[c-11] NormArea[c-12] NormHeight[c-1] NormHeight[c-2] NormHeight[c-3] NormHeight[c-4] NormHeight[c-5] NormHeight[c-6] NormHeight[c-7] NormHeight[c-8] NormHeight[c-9] NormHeight[c-10] NormHeight[c-11] NormHeight[c-12] TopPos[c-1] TopPos[c-2] TopPos[c-3] TopPos[c-4] TopPos[c-5] TopPos[c-6] TopPos[c-7] TopPos[c-8] TopPos[c-9] TopPos[c-10] TopPos[c-11] TopPos[c-12] Hwhm(L)[c-1] Hwhm(L)[c-2] Hwhm(L)[c-3] Hwhm(L)[c-4] Hwhm(L)[c-5] Hwhm(L)[c-6] Hwhm(L)[c-7] Hwhm(L)[c-8] Hwhm(L)[c-9] Hwhm(L)[c-10] Hwhm(L)[c-11] Hwhm(L)[c-12] Hwhm(R)[c-1] Hwhm(R)[c-2] Hwhm(R)[c-3] Hwhm(R)[c-4] Hwhm(R)[c-5] Hwhm(R)[c-6] Hwhm(R)[c-7] Hwhm(R)[c-8] Hwhm(R)[c-9] Hwhm(R)[c-10] Hwhm(R)[c-11] Hwhm(R)[c-12] AreaScore[c-1] AreaScore[c-2] AreaScore[c-3] AreaScore[c-4] AreaScore[c-5] AreaScore[c-6] AreaScore[c-7] AreaScore[c-8] AreaScore[c-9] AreaScore[c-10] AreaScore[c-11] AreaScore[c-12] DataId[c-1] DataId[c-2] DataId[c-3] DataId[c-4] DataId[c-5] DataId[c-6] DataId[c-7] DataId[c-8] DataId[c-9] DataId[c-10] DataId[c-11] DataId[c-12] Scan[c-1] Scan[c-2] Scan[c-3] Scan[c-4] Scan[c-5] Scan[c-6] Scan[c-7] Scan[c-8] Scan[c-9] Scan[c-10] Scan[c-11] Scan[c-12] ObsMz[c-1] ObsMz[c-2] ObsMz[c-3] ObsMz[c-4] ObsMz[c-5] ObsMz[c-6] ObsMz[c-7] ObsMz[c-8] ObsMz[c-9] ObsMz[c-10] ObsMz[c-11] ObsMz[c-12] Rt[c-1] Rt[c-2] Rt[c-3] Rt[c-4] Rt[c-5] Rt[c-6] Rt[c-7] Rt[c-8] Rt[c-9] Rt[c-10] Rt[c-11] Rt[c-12] It.[c-1] It.[c-2] It.[c-3] It.[c-4] It.[c-5] It.[c-6] It.[c-7] It.[c-8] It.[c-9] It.[c-10] It.[c-11] It.[c-12] z[c-1] z[c-2] z[c-3] z[c-4] z[c-5] z[c-6] z[c-7] z[c-8] z[c-9] z[c-10] z[c-11] z[c-12] Delta(Da)[c-1] Delta(Da)[c-2] Delta(Da)[c-3] Delta(Da)[c-4] Delta(Da)[c-5] Delta(Da)[c-6] Delta(Da)[c-7] Delta(Da)[c-8] Delta(Da)[c-9] Delta(Da)[c-10] Delta(Da)[c-11] Delta(Da)[c-12] Delta(ppm)[c-1] Delta(ppm)[c-2] Delta(ppm)[c-3] Delta(ppm)[c-4] Delta(ppm)[c-5] Delta(ppm)[c-6] Delta(ppm)[c-7] Delta(ppm)[c-8] Delta(ppm)[c-9] Delta(ppm)[c-10] Delta(ppm)[c-11] Delta(ppm)[c-12] mScore[c-1] mScore[c-2] mScore[c-3] mScore[c-4] mScore[c-5] mScore[c-6] mScore[c-7] mScore[c-8] mScore[c-9] mScore[c-10] mScore[c-11] mScore[c-12] Grade[c-1] Grade[c-2] Grade[c-3] Grade[c-4] Grade[c-5] Grade[c-6] Grade[c-7] Grade[c-8] Grade[c-9] Grade[c-10] Grade[c-11] Grade[c-12] Occupy[c-1] Occupy[c-2] Occupy[c-3] Occupy[c-4] Occupy[c-5] Occupy[c-6] Occupy[c-7] Occupy[c-8] Occupy[c-9] Occupy[c-10] Occupy[c-11] Occupy[c-12] PQ[c-1] PQ[c-2] PQ[c-3] PQ[c-4] PQ[c-5] PQ[c-6] PQ[c-7] PQ[c-8] PQ[c-9] PQ[c-10] PQ[c-11] PQ[c-12] S/N[c-1] S/N[c-2] S/N[c-3] S/N[c-4] S/N[c-5] S/N[c-6] S/N[c-7] S/N[c-8] S/N[c-9] S/N[c-10] S/N[c-11] S/N[c-12] IntensityRatio[c-1] IntensityRatio[c-2] IntensityRatio[c-3] IntensityRatio[c-4] IntensityRatio[c-5] IntensityRatio[c-6] IntensityRatio[c-7] IntensityRatio[c-8] IntensityRatio[c-9] IntensityRatio[c-10] IntensityRatio[c-11] IntensityRatio[c-12] PeakDataPoint[c-1] PeakDataPoint[c-2] PeakDataPoint[c-3] PeakDataPoint[c-4] PeakDataPoint[c-5] PeakDataPoint[c-6] PeakDataPoint[c-7] PeakDataPoint[c-8] PeakDataPoint[c-9] PeakDataPoint[c-10] PeakDataPoint[c-11] PeakDataPoint[c-12] -0 AcCa(10:1)+H AcCa(10:1)+H AcCa (10:1) (10:1) 314.23258547000006 C17 H32 O4 N1 4653313.704 907625.091 4.458495100384314 1.529403984837583 0.08959308518885947 0.98 940205.63 0.0 4653313.704 0.0 0.0 0.0 0.0 0.0 4553743.803 0.0 0.0 0.0 0.0 0.0 906475.824 0.0 0.0 0.0 0.0 0.0 907625.091 0.0 0.0 0.0 0.0 4.458 4.462 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.043 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.93 0.93 -10 243 -9 -8 -7 -6 -5 245 -4 -3 -2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 314.232401 314.232494 4.458495100384314 4.458 4.458495100384314 4.458495100384314 4.458495100384314 4.458495100384314 4.458495100384314 4.462 4.458495100384314 4.458495100384314 4.458495100384314 4.458495100384314 372563.0 438731.90625 1 1 1 1 1 1 1 1 1 1 1 1 314.23258547000006 1.8447000007881798E-4 314.23258547000006 314.23258547000006 314.23258547000006 314.23258547000006 314.23258547000006 9.147000008624673E-5 314.23258547000006 314.23258547000006 314.23258547000006 314.23258547000006 1000000.0 0.5870492387124804 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2910901170527377 1000000.0 1000000.0 1000000.0 1000000.0 0.0 42.662623744646915 0.0 0.0 0.0 0.0 0.0 42.602196246977684 0.0 0.0 0.0 0.0 A A 0.0 85.32524748929383 0.0 0.0 0.0 0.0 0.0 85.20439249395537 0.0 0.0 0.0 0.0 0.98 0.99 940205.63 934042.56 18.9254 16.2319 0 17 0 0 0 0 0 17 0 0 0 0 -0 AcCa(10:2)+H AcCa(10:2)+H AcCa (10:2) (10:2) 312.21693547000007 C17 H30 O4 N1 1.3281900485E7 3769200.034 4.530551224394264 1.0966842216667214 2.420062391170642 0.98 49.05814250315143 0.0 1.3077490564E7 0.0 0.0 0.0 0.0 0.0 1.3281900485E7 0.0 0.0 0.0 0.0 0.0 3769200.034 0.0 0.0 0.0 0.0 0.0 3642370.094 0.0 0.0 0.0 0.0 4.53 4.532 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.94 0.92 -20 249 -19 -18 -17 -16 -15 249 -14 -13 -12 -11 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 312.21669 312.216855 4.530551224394264 4.53 4.530551224394264 4.530551224394264 4.530551224394264 4.530551224394264 4.530551224394264 4.532 4.530551224394264 4.530551224394264 4.530551224394264 4.530551224394264 734033.5625 316067.40625 1 1 1 1 1 1 1 1 1 1 1 1 312.21693547000007 2.454700000384946E-4 312.21693547000007 312.21693547000007 312.21693547000007 312.21693547000007 312.21693547000007 8.047000005717564E-5 312.21693547000007 312.21693547000007 312.21693547000007 312.21693547000007 1000000.0 0.786216159828015 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.25773746044889917 1000000.0 1000000.0 1000000.0 1000000.0 0.0 32.14591408258129 0.0 0.0 0.0 0.0 0.0 35.01764037003172 0.0 0.0 0.0 0.0 A A 0.0 64.29182816516258 0.0 0.0 0.0 0.0 0.0 70.03528074006344 0.0 0.0 0.0 0.0 0.99 0.98 1065.3772285691887 49.05814250315143 42.9365 55.2798 0 12 0 0 0 0 0 12 0 0 0 0 -0 AcCa(12:2)+H AcCa(12:2)+H AcCa (12:2) (12:2) 340.24823547000005 C19 H34 O4 N1 1822041.542 362482.266 4.31337394035642 2.8944536302375776 3.266141374191801 0.93 109.08999189468314 0.0 1822041.542 0.0 0.0 0.0 0.0 0.0 1748954.404 0.0 0.0 0.0 0.0 0.0 362482.266 0.0 0.0 0.0 0.0 0.0 346117.088 0.0 0.0 0.0 0.0 4.31 4.316 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.044 0.0 0.0 0.0 0.0 1.0 0.85 -30 238 -29 -28 -27 -26 -25 240 -24 -23 -22 -21 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 340.248003 340.247843 4.31337394035642 4.31 4.31337394035642 4.31337394035642 4.31337394035642 4.31337394035642 4.31337394035642 4.316 4.31337394035642 4.31337394035642 4.31337394035642 4.31337394035642 330831.90625 305198.5 1 1 1 1 1 1 1 1 1 1 1 1 340.24823547000005 2.3247000007131646E-4 340.24823547000005 340.24823547000005 340.24823547000005 340.24823547000005 340.24823547000005 3.9247000006525923E-4 340.24823547000005 340.24823547000005 340.24823547000005 340.24823547000005 1000000.0 0.6832364604336457 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.153481367869911 1000000.0 1000000.0 1000000.0 1000000.0 0.0 34.601153250607034 0.0 0.0 0.0 0.0 0.0 35.10145407773791 0.0 0.0 0.0 0.0 A A 0.0 69.20230650121407 0.0 0.0 0.0 0.0 0.0 70.20290815547582 0.0 0.0 0.0 0.0 0.93 0.89 109.08999189468314 9.672940374186169 6.7439 6.9444 0 19 0 0 0 0 0 19 0 0 0 0 -0 AcCa(12:3)+H AcCa(12:3)+H AcCa (12:3) (12:3) 338.23258547000006 C19 H32 O4 N1 4837930.05 1500644.492 4.382016887123876 2.6694892934815373 1.9522641737872535 0.99 442.0351260940032 0.0 4658670.883 0.0 0.0 0.0 0.0 0.0 4837930.05 0.0 0.0 0.0 0.0 0.0 1459777.079 0.0 0.0 0.0 0.0 0.0 1500644.492 0.0 0.0 0.0 0.0 4.381 4.386 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.91 0.88 -40 241 -39 -38 -37 -36 -35 242 -34 -33 -32 -31 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 338.232193 338.232204 4.382016887123876 4.381 4.382016887123876 4.382016887123876 4.382016887123876 4.382016887123876 4.382016887123876 4.386 4.382016887123876 4.382016887123876 4.382016887123876 4.382016887123876 825131.1875 523231.9375 1 1 1 1 1 1 1 1 1 1 1 1 338.23258547000006 3.9247000006525923E-4 338.23258547000006 338.23258547000006 338.23258547000006 338.23258547000006 338.23258547000006 3.8147000003618814E-4 338.23258547000006 338.23258547000006 338.23258547000006 338.23258547000006 1000000.0 1.1603553794791597 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1278333798208897 1000000.0 1000000.0 1000000.0 1000000.0 0.0 19.451775153426503 0.0 0.0 0.0 0.0 0.0 19.822065671207557 0.0 0.0 0.0 0.0 A A 0.0 48.629437883566254 0.0 0.0 0.0 0.0 0.0 49.55516417801889 0.0 0.0 0.0 0.0 1.0 0.99 433.56984348602373 442.0351260940032 26.6304 13.5202 0 14 0 0 0 0 0 14 0 0 0 0 -0 AcCa(14:1)+H AcCa(14:1)+H AcCa (14:1) (14:1) 370.2951854700001 C21 H40 O4 N1 2000252.111 273114.362 4.134244696468352 6.429221731455298 11.816594440641499 0.98 106.52563221041913 0.0 1826291.826 0.0 0.0 0.0 0.0 0.0 2000252.111 0.0 0.0 0.0 0.0 0.0 273114.362 0.0 0.0 0.0 0.0 0.0 230993.182 0.0 0.0 0.0 0.0 4.12 4.146 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.081 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.054 0.0 0.0 0.0 0.0 1.0 0.8 -50 226 -49 -48 -47 -46 -45 229 -44 -43 -42 -41 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 370.29486 370.294901 4.134244696468352 4.12 4.134244696468352 4.134244696468352 4.134244696468352 4.134244696468352 4.134244696468352 4.146 4.134244696468352 4.134244696468352 4.134244696468352 4.134244696468352 243458.875 229863.78125 1 1 1 1 1 1 1 1 1 1 1 1 370.2951854700001 3.254700000638877E-4 370.2951854700001 370.2951854700001 370.2951854700001 370.2951854700001 370.2951854700001 2.8447000011055934E-4 370.2951854700001 370.2951854700001 370.2951854700001 370.2951854700001 1000000.0 0.8789474258240283 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7682249493724677 1000000.0 1000000.0 1000000.0 1000000.0 0.0 26.545101063116608 0.0 0.0 0.0 0.0 0.0 15.85709144150145 0.0 0.0 0.0 0.0 A A 0.0 66.36275265779152 0.0 0.0 0.0 0.0 0.0 52.8569714716715 0.0 0.0 0.0 0.0 0.78 0.98 268.0829014006489 106.52563221041913 11.4132 7.7786 0 22 0 0 0 0 0 24 0 0 0 0 -0 AcCa(14:2)+H AcCa(14:2)+H AcCa (14:2) (14:2) 368.27953547000004 C21 H38 O4 N1 1132513.598 271388.017 4.1670532917627 0.33157954193589495 1.536970481489001 0.97 15.106908434572114 0.0 1132513.598 0.0 0.0 0.0 0.0 0.0 1127215.389 0.0 0.0 0.0 0.0 0.0 265552.535 0.0 0.0 0.0 0.0 0.0 271388.017 0.0 0.0 0.0 0.0 4.164 4.17 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.91 0.89 -60 232 -59 -58 -57 -56 -55 234 -54 -53 -52 -51 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 368.279419 368.279205 4.1670532917627 4.164 4.1670532917627 4.1670532917627 4.1670532917627 4.1670532917627 4.1670532917627 4.17 4.1670532917627 4.1670532917627 4.1670532917627 4.1670532917627 238464.171875 269644.1875 1 1 1 1 1 1 1 1 1 1 1 1 368.27953547000004 1.164700000231278E-4 368.27953547000004 368.27953547000004 368.27953547000004 368.27953547000004 368.27953547000004 3.304700000512639E-4 368.27953547000004 368.27953547000004 368.27953547000004 368.27953547000004 1000000.0 0.31625433619190446 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8973346825517106 1000000.0 1000000.0 1000000.0 1000000.0 0.0 12.626814283876865 0.0 0.0 0.0 0.0 0.0 11.012724713473808 0.0 0.0 0.0 0.0 A A 0.0 63.13407141938433 0.0 0.0 0.0 0.0 0.0 55.063623567369035 0.0 0.0 0.0 0.0 0.97 0.99 15.106908434572114 112.05746945814396 37.1858 15.5808 0 16 0 0 0 0 0 16 0 0 0 0 -0 AcCa(14:3)+H AcCa(14:3)+H AcCa (14:3) (14:3) 366.26388547000005 C21 H36 O4 N1 2930668.415 812283.283 4.2380481799649505 1.5136749071320554 0.5889437645231349 0.99 345.494082152236 0.0 2868597.148 0.0 0.0 0.0 0.0 0.0 2930668.415 0.0 0.0 0.0 0.0 0.0 812283.283 0.0 0.0 0.0 0.0 0.0 805545.896 0.0 0.0 0.0 0.0 4.234 4.242 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.89 0.89 -70 235 -69 -68 -67 -66 -65 237 -64 -63 -62 -61 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 366.263766 366.263839 4.2380481799649505 4.234 4.2380481799649505 4.2380481799649505 4.2380481799649505 4.2380481799649505 4.2380481799649505 4.242 4.2380481799649505 4.2380481799649505 4.2380481799649505 4.2380481799649505 532444.4375 420283.5625 1 1 1 1 1 1 1 1 1 1 1 1 366.26388547000005 1.1947000007239694E-4 366.26388547000005 366.26388547000005 366.26388547000005 366.26388547000005 366.26388547000005 4.647000002933055E-5 366.26388547000005 366.26388547000005 366.26388547000005 366.26388547000005 1000000.0 0.3261855858900467 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.12687573597298282 1000000.0 1000000.0 1000000.0 1000000.0 0.0 20.778027095982434 0.0 0.0 0.0 0.0 0.0 15.033717560826727 0.0 0.0 0.0 0.0 A A 0.0 51.94506773995609 0.0 0.0 0.0 0.0 0.0 50.112391869422424 0.0 0.0 0.0 0.0 1.0 0.99 18.859134423815405 345.494082152236 30.9122 12.4259 0 15 0 0 0 0 0 15 0 0 0 0 -0 AcCa(16:0)+H AcCa(16:0)+H AcCa (16:0) (16:0) 400.34213547 C23 H46 O4 N1 6405075.503 1365831.359 4.051 0.7492497947296823 5.466489575973939 0.99 25.315597433243354 0.0 6405075.503 0.0 0.0 0.0 0.0 0.0 6337565.043 0.0 0.0 0.0 0.0 0.0 1365831.359 0.0 0.0 0.0 0.0 0.0 1264171.445 0.0 0.0 0.0 0.0 4.05 4.053 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.88 0.94 -81 -80 -79 -78 -77 -76 -75 217 -74 -73 -72 -71 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 400.34214 400.341625 4.051 4.05 4.051 4.051 4.051 4.051 4.051 4.053 4.051 4.051 4.051 4.051 248779.0625 1 1 1 1 1 1 1 1 1 1 1 1 400.34213547 4.5299999555936665E-6 400.34213547 400.34213547 400.34213547 400.34213547 400.34213547 5.104699999947115E-4 400.34213547 400.34213547 400.34213547 400.34213547 1000000.0 0.011315321456922003 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2750843710103656 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.352813485707525 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 67.84271161902508 0.0 0.0 0.0 0.0 0.99 0.99 25.315597433243354 14.508256396822588 40.3266 15.185 0 18 0 0 0 0 0 18 0 0 0 0 -0 AcCa(16:1)+H AcCa(16:1)+H AcCa (16:1) (16:1) 398.3264854700001 C23 H44 O4 N1 2796451.572 414196.486 4.053 1.1198976988147331 6.705880239725068 0.99 13.990425958411729 0.0 2752510.052 0.0 0.0 0.0 0.0 0.0 2796451.572 0.0 0.0 0.0 0.0 0.0 414196.486 0.0 0.0 0.0 0.0 0.0 376694.24 0.0 0.0 0.0 0.0 4.053 4.054 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.051 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.065 0.0 0.0 0.0 0.0 1.0 0.88 -91 222 -90 -89 -88 -87 -86 222 -85 -84 -83 -82 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 398.32598 398.325853 4.053 4.053 4.053 4.053 4.053 4.053 4.053 4.054 4.053 4.053 4.053 4.053 269544.09375 290637.65625 1 1 1 1 1 1 1 1 1 1 1 1 398.3264854700001 5.054700000641787E-4 398.3264854700001 398.3264854700001 398.3264854700001 398.3264854700001 398.3264854700001 6.324700000845951E-4 398.3264854700001 398.3264854700001 398.3264854700001 398.3264854700001 1000000.0 1.2689841587303845 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5878180918306763 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.089295960671871 0.0 0.0 0.0 0.0 0.0 18.0982348479456 0.0 0.0 0.0 0.0 B A 0.0 50.89295960671871 0.0 0.0 0.0 0.0 0.0 60.32744949315201 0.0 0.0 0.0 0.0 1.0 0.99 13.825895071462613 13.990425958411729 11.134 11.5821 0 24 0 0 0 0 0 24 0 0 0 0 -0 AcCa(18:1)+H AcCa(18:1)+H AcCa (18:1) (18:1) 426.35778547000007 C25 H48 O4 N1 3991677.168 764681.661 3.961 1.2361191019418374 1.260511836375889 0.99 18.665935891116153 0.0 3922501.846 0.0 0.0 0.0 0.0 0.0 3991677.168 0.0 0.0 0.0 0.0 0.0 751170.62 0.0 0.0 0.0 0.0 0.0 764681.661 0.0 0.0 0.0 0.0 3.952 3.96 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -102 -101 -100 -99 -98 -97 -96 210 -95 -94 -93 -92 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 426.35779 426.357049 3.961 3.952 3.961 3.961 3.961 3.961 3.961 3.96 3.961 3.961 3.961 3.961 432071.6875 1 1 1 1 1 1 1 1 1 1 1 1 426.35778547000007 4.5299999555936665E-6 426.35778547000007 426.35778547000007 426.35778547000007 426.35778547000007 426.35778547000007 7.36470000049394E-4 426.35778547000007 426.35778547000007 426.35778547000007 426.35778547000007 1000000.0 0.010624879174189285 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.727352062394119 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 32.14611917489162 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 80.36529793722906 0.0 0.0 0.0 0.0 0.99 0.99 21.130485778858496 18.665935891116153 36.1271 47.7806 0 20 0 0 0 0 0 18 0 0 0 0 -0 AcCa(18:2)+H AcCa(18:2)+H AcCa (18:2) (18:2) 424.34213547 C25 H46 O4 N1 3599202.886 795402.035 4.002 1.3967385785778925 1.2374054635987568 1.0 36.456070949827655 0.0 3599202.886 0.0 0.0 0.0 0.0 0.0 3528803.606 0.0 0.0 0.0 0.0 0.0 795402.035 0.0 0.0 0.0 0.0 0.0 781603.586 0.0 0.0 0.0 0.0 4.004 4.003 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 1.0 0.94 -113 -112 -111 -110 -109 -108 -107 213 -106 -105 -104 -103 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 424.34214 424.341736 4.002 4.004 4.002 4.002 4.002 4.002 4.002 4.003 4.002 4.002 4.002 4.002 386655.3125 1 1 1 1 1 1 1 1 1 1 1 1 424.34213547 4.5299999555936665E-6 424.34213547 424.34213547 424.34213547 424.34213547 424.34213547 3.994699999907425E-4 424.34213547 424.34213547 424.34213547 424.34213547 1000000.0 0.010675347972635932 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.941386599632136 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 23.497680079263144 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 58.74420019815787 0.0 0.0 0.0 0.0 1.0 1.0 36.456070949827655 28.51504123085447 43.8905 18.2425 0 17 0 0 0 0 0 16 0 0 0 0 -1 AcCa(18:3)+H AcCa(18:3)+H AcCa (18:3) (18:3) 422.3264854700001 C25 H44 O4 N1 1086985.291800001 208222.50999999998 3.532 132.41699411968 117.59914637544126 0.7064132940631357 0.9464662858477696 0.0 35742.28799999986 0.0 0.0 0.0 0.0 0.0 1086985.291800001 0.0 0.0 0.0 0.0 0.0 19150.29999999999 0.0 0.0 0.0 0.0 0.0 208222.50999999998 0.0 0.0 0.0 0.0 3.521 3.515 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 0.94 -124 -123 -122 -121 -120 -119 -118 195 -117 -116 -115 -114 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 422.32649 422.326398 3.532 3.521 3.532 3.532 3.532 3.532 3.532 3.515 3.532 3.532 3.532 3.532 228399.703125 1 1 1 1 1 1 1 1 1 1 1 1 422.3264854700001 4.529999898750248E-6 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 8.747000009634576E-5 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 1000000.0 0.01072629838431489 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.20711464496242013 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.874170794396823 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 39.580569314656074 0.0 0.0 0.0 0.0 0.0 0.7064132940631357 0.3548211470958926 0.9464662858477696 1.0695 2.9604 0 5 0 0 0 0 0 18 0 0 0 0 -1 AcCa(18:3)+H AcCa(18:3)+H AcCa (18:3) (18:3) 422.3264854700001 C25 H44 O4 N1 2467800.134 211470.623 3.77 138.70698141172198 107.14613167866676 0.92 0.8293307784972938 0.0 2467800.134 0.0 0.0 0.0 0.0 0.0 23912.377499999828 0.0 0.0 0.0 0.0 0.0 211470.623 0.0 0.0 0.0 0.0 0.0 29159.900000000023 0.0 0.0 0.0 0.0 3.767 3.768 0.0 0.098 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.084 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.92 -135 -134 -133 -132 -131 -130 -129 202 -128 -127 -126 -125 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 422.32649 422.32607 3.77 3.767 3.77 3.77 3.77 3.77 3.77 3.768 3.77 3.77 3.77 3.77 223242.578125 1 1 1 1 1 1 1 1 1 1 1 1 422.3264854700001 4.529999898750248E-6 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 4.1547000006403323E-4 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 1000000.0 0.01072629838431489 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9837649646852331 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 12.491465712817357 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 41.63821904272453 0.0 0.0 0.0 0.0 0.92 0.0 0.8293307784972938 0.4864431857486705 2.0829 1.143 0 29 0 0 0 0 0 3 0 0 0 0 -0 AcCa(18:3)+H AcCa(18:3)+H AcCa (18:3) (18:3) 422.3264854700001 C25 H44 O4 N1 1.5725369501E7 3197891.505 4.053935686942069 1.4145486399477862 2.3710114598066454 0.99 484.5836228190314 0.0 1.5413902996E7 0.0 0.0 0.0 0.0 0.0 1.5725369501E7 0.0 0.0 0.0 0.0 0.0 3197891.505 0.0 0.0 0.0 0.0 0.0 3092430.589 0.0 0.0 0.0 0.0 4.056 4.058 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.88 0.92 -145 227 -144 -143 -142 -141 -140 215 -139 -138 -137 -136 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 422.325627 422.325779 4.053935686942069 4.056 4.053935686942069 4.053935686942069 4.053935686942069 4.053935686942069 4.053935686942069 4.058 4.053935686942069 4.053935686942069 4.053935686942069 4.053935686942069 988964.3125 479079.65625 1 1 1 1 1 1 1 1 1 1 1 1 422.3264854700001 8.584700000824341E-4 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 7.064700000682933E-4 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 1000000.0 2.032716463726061 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6728053398831348 1000000.0 1000000.0 1000000.0 1000000.0 0.0 13.027299280784838 0.0 0.0 0.0 0.0 0.0 12.126968151566896 0.0 0.0 0.0 0.0 A A 0.0 43.42433093594946 0.0 0.0 0.0 0.0 0.0 40.42322717188965 0.0 0.0 0.0 0.0 1.0 0.99 15.747283476210919 484.5836228190314 42.8026 16.2842 0 18 0 0 0 0 0 18 0 0 0 0 -0 AcCa(6:0)+H AcCa(6:0)+H AcCa (6:0) (6:0) 260.1856354700001 C13 H26 O4 N1 2354211.399 648220.068 4.933 0.8031244689952243 2.388257758432676 0.97 174.75436805379445 0.0 0.0 2354211.399 0.0 0.0 0.0 0.0 0.0 2327623.504 0.0 0.0 0.0 0.0 0.0 626689.983 0.0 0.0 0.0 0.0 0.0 648220.068 0.0 0.0 0.0 4.932 4.933 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.87 0.88 -156 -155 -154 -153 -152 -151 -150 -149 360 -148 -147 -146 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 260.18564 260.185113 4.933 4.933 4.932 4.933 4.933 4.933 4.933 4.933 4.933 4.933 4.933 4.933 262062.703125 1 1 1 1 1 1 1 1 1 1 1 1 260.1856354700001 260.1856354700001 4.529999898750248E-6 260.1856354700001 260.1856354700001 260.1856354700001 260.1856354700001 260.1856354700001 5.224700000781013E-4 260.1856354700001 260.1856354700001 260.1856354700001 1000000.0 1000000.0 0.017410645636017696 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.0080662759660424 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 31.995912694088798 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 79.989781735222 0.0 0.0 0.0 0.97 0.98 174.75436805379445 186.64787293178992 28.9856 28.3038 0 0 14 0 0 0 0 0 13 0 0 0 -0 AcCa(8:0)+H AcCa(8:0)+H AcCa (8:0) (8:0) 288.21693547000007 C15 H30 O4 N1 2467105.61 715554.695 4.607 3.6930332638301944 4.488332424501596 0.99 708813.19 0.0 0.0 2341534.285 0.0 0.0 0.0 0.0 0.0 2467105.61 0.0 0.0 0.0 0.0 0.0 671532.295 0.0 0.0 0.0 0.0 0.0 715554.695 0.0 0.0 0.0 4.606 4.605 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -167 -166 -165 -164 -163 -162 -161 -160 338 -159 -158 -157 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 288.21694 288.216633 4.607 4.607 4.606 4.607 4.607 4.607 4.607 4.607 4.605 4.607 4.607 4.607 466588.0 1 1 1 1 1 1 1 1 1 1 1 1 288.21693547000007 288.21693547000007 4.5299999555936665E-6 288.21693547000007 288.21693547000007 288.21693547000007 288.21693547000007 288.21693547000007 3.024700000651137E-4 288.21693547000007 288.21693547000007 288.21693547000007 1000000.0 1000000.0 0.015717327464489627 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0494525575739362 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.272691112077222 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 52.545382224154444 0.0 0.0 0.0 1.0 0.99 293.9626989601135 708813.19 52.2606 51.3523 0 0 12 0 0 0 0 0 11 0 0 0 -0 AcCa(9:0)+H AcCa(9:0)+H AcCa (9:0) (9:0) 302.23258547000006 C16 H32 O4 N1 3670623.045 705815.416 4.516948790329165 28.755055634024696 28.892509586001154 1.0 28.534019031603055 0.0 2167626.352 3524967.288 0.0 0.0 0.0 0.0 2164631.925 3670623.045 0.0 0.0 0.0 0.0 400903.053 676510.391 0.0 0.0 0.0 0.0 430632.94 705815.416 0.0 0.0 0.0 4.506 4.521 4.518 4.515 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -175 247 269 -174 -173 -172 -171 248 333 -170 -169 -168 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 302.232605 302.232485 302.232544 302.232376 4.516948790329165 4.506 4.521 4.516948790329165 4.516948790329165 4.516948790329165 4.516948790329165 4.518 4.515 4.516948790329165 4.516948790329165 4.516948790329165 353982.78125 268602.5 287862.53125 292016.5 1 1 1 1 1 1 1 1 1 1 1 1 302.23258547000006 1.9529999917722307E-5 1.0047000006352391E-4 302.23258547000006 302.23258547000006 302.23258547000006 302.23258547000006 4.1470000041954336E-5 2.0947000007254246E-4 302.23258547000006 302.23258547000006 302.23258547000006 1000000.0 0.06461910745775915 0.33242610126662425 1000000.0 1000000.0 1000000.0 1000000.0 0.13721220687525995 0.6930754992774751 1000000.0 1000000.0 1000000.0 0.0 17.016550937578987 39.91408532364246 0.0 0.0 0.0 0.0 21.089641872561398 26.905783281094042 0.0 0.0 0.0 A A A A 0.0 56.72183645859663 79.82817064728492 0.0 0.0 0.0 0.0 52.724104681403496 53.811566562188084 0.0 0.0 0.0 0.97 0.99 1.0 1.0 70.13732399968181 62.312308423737676 74.741696235887 28.534019031603055 16.3094 15.1056 16.0881 16.6955 0 18 19 0 0 0 0 18 18 0 0 0 -0 Cer(d18:0_16:0+O)+H Cer(d34:0+O)+H Cer (d18:0_16:0+O) (d18:0) (16:0+O) 556.5299354700002 C34 H70 O4 N1 3832585.814 1769075.066 0.4538680329650538 7.694627606859071 10.002584721969008 0.82 1661662.63 3832585.814 0.0 0.0 0.0 0.0 0.0 3437050.475 0.0 0.0 0.0 0.0 0.0 1769075.066 0.0 0.0 0.0 0.0 0.0 1535356.103 0.0 0.0 0.0 0.0 0.0 0.45 0.457 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 24 -185 -184 -183 -182 -181 24 -180 -179 -178 -177 -176 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 556.529949 556.530197 0.45 0.4538680329650538 0.4538680329650538 0.4538680329650538 0.4538680329650538 0.4538680329650538 0.457 0.4538680329650538 0.4538680329650538 0.4538680329650538 0.4538680329650538 0.4538680329650538 1420125.5 925620.8125 1 1 1 1 1 1 1 1 1 1 1 1 1.3529999819184013E-5 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 2.6152999987516523E-4 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 0.024311360372299955 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.46992979749471725 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 22.801541675539685 0.0 0.0 0.0 0.0 0.0 19.41878875230577 0.0 0.0 0.0 0.0 0.0 B B 45.60308335107937 0.0 0.0 0.0 0.0 0.0 48.546971880764424 0.0 0.0 0.0 0.0 0.0 0.82 0.87 1661662.63 1509605.0 95.2159 77.9028 6 0 0 0 0 0 6 0 0 0 0 0 -0 Cer(d18:1_16:0)+H Cer(d34:1)+H Cer (d18:1_16:0) (d18:1) (16:0) 538.51937047 C34 H68 O3 N1 2775666.552 1128474.522 0.43497109575092036 4.958564114489468 13.006410485774166 0.93 4910.053552171849 2775666.552 0.0 0.0 0.0 0.0 0.0 2587617.255 0.0 0.0 0.0 0.0 0.0 1128474.522 0.0 0.0 0.0 0.0 0.0 938386.908 0.0 0.0 0.0 0.0 0.0 0.449 0.449 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -196 -195 -194 -193 -192 -191 11 -190 -189 -188 -187 -186 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 538.51937 538.518616 0.449 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.449 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 398930.59375 1 1 1 1 1 1 1 1 1 1 1 1 4.70000031782547E-7 538.51937047 538.51937047 538.51937047 538.51937047 538.51937047 7.544700000607918E-4 538.51937047 538.51937047 538.51937047 538.51937047 538.51937047 8.727634650771209E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4010081000472052 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.836210886230938 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 22.787369620769795 0.0 0.0 0.0 0.0 0.0 0.93 0.97 4910.053552171849 218.62378140209734 10.2722 20.2822 9 0 0 0 0 0 9 0 0 0 0 0 -0 Cer(d34:1)+H-H2O Cer(d34:1)+H-H2O Cer (d18:1_16:0) (d18:1) (16:0) 520.50880547 C34 H66 O2 N1 1.3297173839E7 4977411.948 0.43497109575092036 5.949587338146946 5.1194143657973665 0.91 170.59104256161146 1.2223519899E7 0.0 0.0 0.0 0.0 0.0 1.3297173839E7 0.0 0.0 0.0 0.0 0.0 4977411.948 0.0 0.0 0.0 0.0 0.0 4629639.323 0.0 0.0 0.0 0.0 0.0 0.44 0.434 0.017 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 16 -206 -205 -204 -203 -202 21 -201 -200 -199 -198 -197 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.508606 520.508606 0.44 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.434 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 0.43497109575092036 4907558.5 3156180.25 1 1 1 1 1 1 1 1 1 1 1 1 1.994699999841032E-4 520.50880547 520.50880547 520.50880547 520.50880547 520.50880547 1.994699999841032E-4 520.50880547 520.50880547 520.50880547 520.50880547 520.50880547 0.3832211825964966 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3832211825964966 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.454404769547945 0.0 0.0 0.0 0.0 0.0 6.262809678677447 0.0 0.0 0.0 0.0 0.0 C C 37.272023847739725 0.0 0.0 0.0 0.0 0.0 31.31404839338724 0.0 0.0 0.0 0.0 0.0 0.96 0.91 115.00474381341868 170.59104256161146 31.1864 34.6414 8 0 0 0 0 0 8 0 0 0 0 0 -0 Cer(d18:1_16:1)+H Cer(d34:2)+H Cer (d18:1_16:1) (d18:1) (16:1) 536.5037204700001 C34 H66 O3 N1 3601511.205 1658391.036 0.48087341337844935 6.264761060047573 18.484842882435323 0.83 3128.1830926083267 3601511.205 0.0 0.0 0.0 0.0 0.0 3295963.093 0.0 0.0 0.0 0.0 0.0 1658391.036 0.0 0.0 0.0 0.0 0.0 1274977.536 0.0 0.0 0.0 0.0 0.0 0.481 0.481 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 28 -216 -215 -214 -213 -212 27 -211 -210 -209 -208 -207 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 536.503845 536.50459 0.481 0.48087341337844935 0.48087341337844935 0.48087341337844935 0.48087341337844935 0.48087341337844935 0.481 0.48087341337844935 0.48087341337844935 0.48087341337844935 0.48087341337844935 0.48087341337844935 1657106.5 1248373.75 1 1 1 1 1 1 1 1 1 1 1 1 1.2452999987999647E-4 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 8.695299999317285E-4 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 0.23211395397389398 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6207343337153064 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 35.79675763591923 0.0 0.0 0.0 0.0 0.0 35.52241809486118 0.0 0.0 0.0 0.0 0.0 B B 89.49189408979808 0.0 0.0 0.0 0.0 0.0 88.80604523715294 0.0 0.0 0.0 0.0 0.0 0.83 0.86 3128.1830926083267 97.11240828732049 32.9073 21.8425 6 0 0 0 0 0 6 0 0 0 0 0 -1 LPC(14:0)+H LPC(14:0)+H LPC (14:0) (14:0) 468.30846847000004 C22 H47 O7 N1 P1 631850.1675000023 405513.42 5.099273674186483 5.781439948930326 10.784950029606525 0.6783897743683749 1.6319136155581453 0.0 631850.1675000023 0.0 0.0 0.0 0.0 0.0 582217.9064999996 0.0 0.0 0.0 0.0 0.0 405513.42 0.0 0.0 0.0 0.0 0.0 348046.12999999995 0.0 0.0 0.0 0.0 5.091 5.102 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.85 0.89 -226 317 -225 -224 -223 -222 -221 308 -220 -219 -218 -217 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 468.307921 468.307149 5.099273674186483 5.091 5.099273674186483 5.099273674186483 5.099273674186483 5.099273674186483 5.099273674186483 5.102 5.099273674186483 5.099273674186483 5.099273674186483 5.099273674186483 1016473.0 340220.4375 1 1 1 1 1 1 1 1 1 1 1 1 468.30846847000004 5.474700000149824E-4 468.30846847000004 468.30846847000004 468.30846847000004 468.30846847000004 468.30846847000004 0.0013194700000553894 468.30846847000004 468.30846847000004 468.30846847000004 468.30846847000004 1000000.0 1.169037155795216 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.817523254205075 1000000.0 1000000.0 1000000.0 1000000.0 0.0 37.779261756195424 0.0 0.0 0.0 0.0 0.0 6.546650364673688 0.0 0.0 0.0 0.0 B B 0.0 62.756248764444244 0.0 0.0 0.0 0.0 0.0 21.813922209763103 0.0 0.0 0.0 0.0 0.6783897743683749 0.0 1.6319136155581453 0.8581236270852202 3.8829 3.2834 0 8 0 0 0 0 0 6 0 0 0 0 -0 LPC(15:0)+H LPC(15:0)+H LPC (15:0) (15:0) 482.32411847000003 C23 H49 O7 N1 P1 948047.207 371492.443 5.077 1.1280345206339653 1.7875574950765452 0.94 26.98231979708089 0.0 948047.207 0.0 0.0 0.0 0.0 0.0 933042.864 0.0 0.0 0.0 0.0 0.0 371492.443 0.0 0.0 0.0 0.0 0.0 362218.382 0.0 0.0 0.0 0.0 5.074 5.076 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.92 0.91 -237 -236 -235 -234 -233 -232 -231 302 -230 -229 -228 -227 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 482.32412 482.32385 5.077 5.074 5.077 5.077 5.077 5.077 5.077 5.076 5.077 5.077 5.077 5.077 455181.59375 1 1 1 1 1 1 1 1 1 1 1 1 482.32411847000003 1.5299999631679384E-6 482.32411847000003 482.32411847000003 482.32411847000003 482.32411847000003 482.32411847000003 2.684700000372686E-4 482.32411847000003 482.32411847000003 482.32411847000003 482.32411847000003 1000000.0 0.0031721406924897586 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5566174067531461 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.1852635298221 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.80614346589055 0.0 0.0 0.0 0.0 0.94 0.91 26.98231979708089 239.19198978971684 6.0409 19.5026 0 10 0 0 0 0 0 10 0 0 0 0 -0 LPC(16:0)+H LPC(16:0)+H LPC (16:0) (16:0) 496.3397684700001 C24 H51 O7 N1 P1 5970902.609 1786076.081 4.983 2.920294629474216 2.397852903648716 0.92 110.08996429151675 0.0 5970902.609 0.0 0.0 0.0 0.0 0.0 5729298.128 0.0 0.0 0.0 0.0 0.0 1786076.081 0.0 0.0 0.0 0.0 0.0 1726518.7 0.0 0.0 0.0 0.0 4.977 4.983 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.88 0.89 -248 -247 -246 -245 -244 -243 -242 285 -241 -240 -239 -238 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 496.33977 496.338284 4.983 4.977 4.983 4.983 4.983 4.983 4.983 4.983 4.983 4.983 4.983 4.983 516789.46875 1 1 1 1 1 1 1 1 1 1 1 1 496.3397684700001 1.5299999063245195E-6 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 0.0014844700000935518 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 1000000.0 0.0030825656204032264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.9908342921413045 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 16.749250865873993 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.80974011252149 0.0 0.0 0.0 0.0 0.92 0.96 110.08996429151675 91.0253098390701 10.7152 8.6119 0 8 0 0 0 0 0 6 0 0 0 0 -0 LPC(16:0)+H LPC(16:0)+H LPC (16:0) (16:0) 496.3397684700001 C24 H51 O7 N1 P1 8.049882542E7 3.2038844957E7 5.146 3.2645849673417375 0.7878246849910349 0.96 1342.0951183551697 0.0 7.6866195281E7 0.0 0.0 0.0 0.0 0.0 8.049882542E7 0.0 0.0 0.0 0.0 0.0 3.1683860943E7 0.0 0.0 0.0 0.0 0.0 3.2038844957E7 0.0 0.0 0.0 0.0 5.146 5.149 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.89 0.87 -259 -258 -257 -256 -255 -254 -253 316 -252 -251 -250 -249 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 496.33977 496.338647 5.146 5.146 5.146 5.146 5.146 5.146 5.146 5.149 5.146 5.146 5.146 5.146 2510829.0 1 1 1 1 1 1 1 1 1 1 1 1 496.3397684700001 1.5299999063245195E-6 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 0.001121470000100544 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 1000000.0 0.0030825656204032264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.259480443321213 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 34.00802841792229 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 56.585737800203496 0.0 0.0 0.0 0.0 0.97 0.96 549.2848673175649 1342.0951183551697 12.4617 17.4718 0 9 0 0 0 0 0 10 0 0 0 0 -0 LPC(16:1)+H LPC(16:1)+H LPC (16:1) (16:1) 494.32411847000003 C24 H49 O7 N1 P1 1.1975399132E7 4737393.211 5.1425205375025556 3.001218858138046 4.938183908442623 0.99 884.6200235209603 0.0 1.1975399132E7 0.0 0.0 0.0 0.0 0.0 1.1477682017E7 0.0 0.0 0.0 0.0 0.0 4737393.211 0.0 0.0 0.0 0.0 0.0 4417713.074 0.0 0.0 0.0 0.0 5.156 5.158 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.91 0.91 -269 323 -268 -267 -266 -265 -264 334 -263 -262 -261 -260 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 494.322951 494.322754 5.1425205375025556 5.156 5.1425205375025556 5.1425205375025556 5.1425205375025556 5.1425205375025556 5.1425205375025556 5.158 5.1425205375025556 5.1425205375025556 5.1425205375025556 5.1425205375025556 132746.828125 142007.71875 1 1 1 1 1 1 1 1 1 1 1 1 494.32411847000003 0.0011674700000412486 494.32411847000003 494.32411847000003 494.32411847000003 494.32411847000003 494.32411847000003 0.0013644700000554622 494.32411847000003 494.32411847000003 494.32411847000003 494.32411847000003 1000000.0 2.3617500267936067 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.760273976270228 1000000.0 1000000.0 1000000.0 1000000.0 0.0 20.25385146280525 0.0 0.0 0.0 0.0 0.0 19.901258937746952 0.0 0.0 0.0 0.0 B B 0.0 50.50835776260663 0.0 0.0 0.0 0.0 0.0 49.38277652046391 0.0 0.0 0.0 0.0 0.99 0.99 884.6200235209603 5332877.5 16.1827 15.1391 0 11 0 0 0 0 0 11 0 0 0 0 -0 LPC(17:1)+H LPC(17:1)+H LPC (17:1) (17:1) 508.3397684700001 C25 H51 O7 N1 P1 718572.464 249040.254 5.0421660455100685 12.915075401643167 5.434053682945025 0.9 75.50140402143701 575749.804 606893.333 0.0 0.0 0.0 0.0 535184.11 718572.464 0.0 0.0 0.0 0.0 228056.284 249040.254 0.0 0.0 0.0 0.0 244375.973 222223.542 0.0 0.0 0.0 0.0 5.038 5.035 5.045 5.043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 1.0 1.0 1.0 0.89 327 308 -277 -276 -275 -274 337 300 -273 -272 -271 -270 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 508.34137 508.338959 508.341217 508.338226 5.038 5.035 5.0421660455100685 5.0421660455100685 5.0421660455100685 5.0421660455100685 5.045 5.043 5.0421660455100685 5.0421660455100685 5.0421660455100685 5.0421660455100685 213497.9375 761068.8125 247446.640625 149693.15625 1 1 1 1 1 1 1 1 1 1 1 1 0.0016015299999025956 8.094700000924604E-4 508.3397684700001 508.3397684700001 508.3397684700001 508.3397684700001 0.0014485299998909795 0.0015424700000608027 508.3397684700001 508.3397684700001 508.3397684700001 508.3397684700001 3.150510936263903 1.592379841791252 1000000.0 1000000.0 1000000.0 1000000.0 2.8495311398727705 3.0343288008005462 1000000.0 1000000.0 1000000.0 1000000.0 6.817930609362342 22.30078863571594 0.0 0.0 0.0 0.0 13.714398690238973 18.776320400809063 0.0 0.0 0.0 0.0 B B B B 34.29026896264836 55.6129392411869 0.0 0.0 0.0 0.0 45.697388667167886 46.70726467862952 0.0 0.0 0.0 0.0 0.94 0.81 0.88 0.9 228420.03 350.51335163277787 247446.64 75.50140402143701 13.9048 17.0801 9.798 15.0353 10 10 0 0 0 0 9 17 0 0 0 0 -0 LPC(18:0)+H LPC(18:0)+H LPC (18:0) (18:0) 524.37106847 C26 H55 O7 N1 P1 1577143.294 675051.505 5.106 3.1188487222533876 2.9264278104389754 0.97 2731.8035415812546 1509080.967 0.0 0.0 0.0 0.0 0.0 1577143.294 0.0 0.0 0.0 0.0 0.0 647680.257 0.0 0.0 0.0 0.0 0.0 675051.505 0.0 0.0 0.0 0.0 0.0 5.105 5.106 0.016 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.86 0.88 -288 -287 -286 -285 -284 -283 347 -282 -281 -280 -279 -278 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 524.37107 524.370474 5.105 5.106 5.106 5.106 5.106 5.106 5.106 5.106 5.106 5.106 5.106 5.106 680569.6875 1 1 1 1 1 1 1 1 1 1 1 1 1.5300000768547761E-6 524.37106847 524.37106847 524.37106847 524.37106847 524.37106847 5.944700000100056E-4 524.37106847 524.37106847 524.37106847 524.37106847 524.37106847 0.0029177812599748905 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1336819205997366 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 17.15177032271962 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 42.45487703643471 0.0 0.0 0.0 0.0 0.0 0.97 0.97 1355.56987081762 2731.8035415812546 14.9812 17.0197 12 0 0 0 0 0 10 0 0 0 0 0 -0 LPC(18:1)+H LPC(18:1)+H LPC (18:1) (18:1) 522.35541847 C26 H53 O7 N1 P1 1.0065278951E7 3264697.402 5.017 1.1349897776580744 5.082843906814183 0.86 289.8006352111853 9905005.641 0.0 0.0 0.0 0.0 0.0 1.0065278951E7 0.0 0.0 0.0 0.0 0.0 3264697.402 0.0 0.0 0.0 0.0 0.0 3038165.367 0.0 0.0 0.0 0.0 0.0 5.013 5.013 0.021 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.88 0.83 -299 -298 -297 -296 -295 -294 307 -293 -292 -291 -290 -289 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 522.35542 522.354991 5.013 5.017 5.017 5.017 5.017 5.017 5.013 5.017 5.017 5.017 5.017 5.017 217773.734375 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 522.35541847 522.35541847 522.35541847 522.35541847 522.35541847 4.274699999768927E-4 522.35541847 522.35541847 522.35541847 522.35541847 522.35541847 0.0029290400923749765 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.818350848602221 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 9.79359089509014 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 49.256128456577756 0.0 0.0 0.0 0.0 0.0 0.9 0.86 494.10106206152716 289.8006352111853 15.9332 13.5282 11 0 0 0 0 0 10 0 0 0 0 0 -0 LPC(18:2)+H LPC(18:2)+H LPC (18:2) (18:2) 520.3397684700001 C26 H51 O7 N1 P1 4371766.379 1189775.335 4.965 6.906804197878008 6.383529112738616 0.92 67.51727424406796 4371766.379 0.0 0.0 0.0 0.0 0.0 3964629.47 0.0 0.0 0.0 0.0 0.0 1087005.18 0.0 0.0 0.0 0.0 0.0 1189775.335 0.0 0.0 0.0 0.0 0.0 4.968 4.965 0.032 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.86 0.86 -310 -309 -308 -307 -306 -305 314 -304 -303 -302 -301 -300 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.33977 520.339321 4.968 4.965 4.965 4.965 4.965 4.965 4.965 4.965 4.965 4.965 4.965 4.965 551659.0625 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 4.474700000400844E-4 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 0.0029403863703647507 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8599573339470459 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 16.519048197308212 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 54.86042727435058 0.0 0.0 0.0 0.0 0.0 0.92 0.98 67.51727424406796 51.652666026928195 6.021 7.1067 7 0 0 0 0 0 6 0 0 0 0 0 -0 LPC(18:2)+H LPC(18:2)+H LPC (18:2) (18:2) 520.3397684700001 C26 H51 O7 N1 P1 4.7008124691E7 2.0519977831E7 5.131 7.694930178356982 8.723840876639269 0.98 1444.085400225479 4.7008124691E7 0.0 0.0 0.0 0.0 0.0 4.215655219E7 0.0 0.0 0.0 0.0 0.0 2.0519977831E7 0.0 0.0 0.0 0.0 0.0 1.8135445727E7 0.0 0.0 0.0 0.0 0.0 5.132 5.131 0.017 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.89 0.87 -321 -320 -319 -318 -317 -316 352 -315 -314 -313 -312 -311 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.33977 520.339417 5.132 5.131 5.131 5.131 5.131 5.131 5.131 5.131 5.131 5.131 5.131 5.131 1.8952772E7 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 3.5147000005508744E-4 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 0.0029403863703647507 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6754624984527803 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 20.313038172211307 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 50.2797974559686 0.0 0.0 0.0 0.0 0.0 0.98 0.97 1444.085400225479 613.1637799983959 17.5099 9.9821 10 0 0 0 0 0 11 0 0 0 0 0 -0 LPC(18:3)+H LPC(18:3)+H LPC (18:3) (18:3) 518.32411847 C26 H49 O7 N1 P1 1.1455793223E7 4173147.168 4.999827841054959 0.7582076871311171 10.153797018666083 0.91 63.25231153864673 1.1333611522E7 0.0 0.0 0.0 0.0 0.0 1.1455793223E7 0.0 0.0 0.0 0.0 0.0 4173147.168 0.0 0.0 0.0 0.0 0.0 3614041.162 0.0 0.0 0.0 0.0 0.0 4.982 4.983 0.024 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.9 0.86 -332 -331 -330 -329 -328 -327 322 -326 -325 -324 -323 -322 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 518.32412 518.323853 4.982 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.983 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 1822323.5 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 2.654700000448429E-4 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 0.002951820894779553 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5121698770808945 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 23.80758246858323 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 59.370529846841 0.0 0.0 0.0 0.0 0.0 0.94 0.91 80.56399600734154 63.25231153864673 7.3828 5.4727 6 0 0 0 0 0 6 0 0 0 0 0 -0 LPC(18:3)+Na LPC(18:3)+Na LPC (18:3) (18:3) 540.30606347 C26 H48 O7 N1 P1 Na1 120931.19 35194.371 4.999827841054959 47.535904760320626 31.590598376160994 0.95 11.61469319372911 120931.19 0.0 0.0 0.0 0.0 0.0 60085.96500000028 0.0 0.0 0.0 0.0 0.0 35194.371 0.0 0.0 0.0 0.0 0.0 22341.95 0.0 0.0 0.0 0.0 0.0 4.991 4.974 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.92 326 -342 -341 -340 -339 -338 336 -337 -336 -335 -334 -333 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 540.305486 540.305274 4.991 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.974 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 4.999827841054959 579303.8125 356793.09375 1 1 1 1 1 1 1 1 1 1 1 1 5.774700000529265E-4 540.30606347 540.30606347 540.30606347 540.30606347 540.30606347 7.894699999724253E-4 540.30606347 540.30606347 540.30606347 540.30606347 540.30606347 1.068783119597528 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4611533228078604 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.026954381467025 0.0 0.0 0.0 0.0 0.0 11.310728923138054 0.0 0.0 0.0 0.0 0.0 B B 66.90355356175651 0.0 0.0 0.0 0.0 0.0 55.99370754028742 0.0 0.0 0.0 0.0 0.0 0.95 0.4641067761130849 11.61469319372911 0.0 13.9086 14.1365 5 0 0 0 0 0 5 0 0 0 0 0 -0 LPC(18:3)+H LPC(18:3)+H LPC (18:3) (18:3) 518.32411847 C26 H49 O7 N1 P1 1.73769295077E8 7.0111329561E7 5.151 14.580295129357049 11.676424723725354 0.98 945.8079471996688 1.73769295077E8 0.0 0.0 0.0 0.0 0.0 1.41287490116E8 0.0 0.0 0.0 0.0 0.0 7.0111329561E7 0.0 0.0 0.0 0.0 0.0 5.9416861532E7 0.0 0.0 0.0 0.0 0.0 5.151 5.152 0.021 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.87 0.89 -353 -352 -351 -350 -349 -348 353 -347 -346 -345 -344 -343 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 518.32412 518.324402 5.151 5.151 5.151 5.151 5.151 5.151 5.152 5.151 5.151 5.151 5.151 5.151 5325402.0 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 2.835299999333074E-4 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 0.002951820894779553 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5470129400311087 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 20.26761859818212 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 50.29185756372736 0.0 0.0 0.0 0.0 0.0 0.98 0.98 945.8079471996688 834.1898623111056 11.9499 13.6813 11 0 0 0 0 0 10 0 0 0 0 0 -0 LPC(20:1)+H LPC(20:1)+H LPC (20:1) (20:1) 550.38671847 C28 H57 O7 N1 P1 471580.893 180115.182 5.075 2.903590048253427 3.3582480072800043 0.98 210.86059548276947 471580.893 0.0 0.0 0.0 0.0 0.0 452605.967 0.0 0.0 0.0 0.0 0.0 171759.427 0.0 0.0 0.0 0.0 0.0 180115.182 0.0 0.0 0.0 0.0 0.0 5.073 5.076 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.96 0.92 -364 -363 -362 -361 -360 -359 345 -358 -357 -356 -355 -354 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 550.38672 550.386351 5.073 5.075 5.075 5.075 5.075 5.075 5.076 5.075 5.075 5.075 5.075 5.075 169331.28125 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 550.38671847 550.38671847 550.38671847 550.38671847 550.38671847 3.674700000146913E-4 550.38671847 550.38671847 550.38671847 550.38671847 550.38671847 0.002779863524725178 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6676578261848465 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 18.02029458183939 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 44.93839047840248 0.0 0.0 0.0 0.0 0.0 0.98 0.99 210.86059548276947 353.6752773925104 6.9995 5.6552 12 0 0 0 0 0 11 0 0 0 0 0 -0 LPC(20:2)+H LPC(20:2)+H LPC (20:2) (20:2) 548.37106847 C28 H55 O7 N1 P1 937107.435 524563.27 5.097 5.424918586794272 21.471310063401223 0.99 55.99745886269167 867868.613 0.0 0.0 0.0 0.0 0.0 937107.435 0.0 0.0 0.0 0.0 0.0 386275.146 0.0 0.0 0.0 0.0 0.0 524563.27 0.0 0.0 0.0 0.0 0.0 5.096 5.098 0.016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 335 -375 -374 -373 -372 -371 -370 -369 -368 -367 -366 -365 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 548.370447 548.37107 5.096 5.097 5.097 5.097 5.097 5.097 5.098 5.097 5.097 5.097 5.097 5.097 477057.0625 1 1 1 1 1 1 1 1 1 1 1 1 6.214699999418372E-4 548.37106847 548.37106847 548.37106847 548.37106847 548.37106847 1.5300000768547761E-6 548.37106847 548.37106847 548.37106847 548.37106847 548.37106847 1.1333019476680075 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002790081688889243 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 18.616980941120676 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 46.42638638683462 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 13.557574291356842 55.99745886269167 8.5054 8.1394 11 0 0 0 0 0 8 0 0 0 0 0 -0 LPC(20:3)+H LPC(20:3)+H LPC (20:3) (20:3) 546.35541847 C28 H53 O7 N1 P1 2420737.748 863454.432 5.014 2.6118719745951346 3.820346342810205 0.89 814.7259576727604 2420737.748 0.0 0.0 0.0 0.0 0.0 2332943.325 0.0 0.0 0.0 0.0 0.0 863454.432 0.0 0.0 0.0 0.0 0.0 818030.908 0.0 0.0 0.0 0.0 0.0 5.016 5.017 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.87 0.88 -386 -385 -384 -383 -382 -381 361 -380 -379 -378 -377 -376 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 546.35542 546.354605 5.016 5.014 5.014 5.014 5.014 5.014 5.017 5.014 5.014 5.014 5.014 5.014 112600.773438 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 546.35541847 546.35541847 546.35541847 546.35541847 546.35541847 8.13470000025518E-4 546.35541847 546.35541847 546.35541847 546.35541847 546.35541847 0.002800374831922619 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4889025944018985 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 16.640309118789954 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 41.18888395740089 0.0 0.0 0.0 0.0 0.0 0.89 0.9 814.7259576727604 753.481886340242 14.9444 14.5671 11 0 0 0 0 0 10 0 0 0 0 0 -0 LPC(20:5)+H LPC(20:5)+H LPC (20:5) (20:5) 542.32411847 C28 H49 O7 N1 P1 877542.442 208293.945 5.036 1.731820813124451 5.45451935386913 0.97 445.4667746215078 856309.993 0.0 0.0 0.0 0.0 0.0 877542.442 0.0 0.0 0.0 0.0 0.0 208293.945 0.0 0.0 0.0 0.0 0.0 192823.149 0.0 0.0 0.0 0.0 0.0 5.038 5.037 0.032 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.91 0.89 -397 -396 -395 -394 -393 -392 335 -391 -390 -389 -388 -387 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 542.32412 542.32161 5.038 5.036 5.036 5.036 5.036 5.036 5.037 5.036 5.036 5.036 5.036 5.036 209306.875 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 542.32411847 542.32411847 542.32411847 542.32411847 542.32411847 0.002508470000066154 542.32411847 542.32411847 542.32411847 542.32411847 542.32411847 0.0028211910757064626 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.625407417142036 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.410047378453048 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 24.367010689672984 0.0 0.0 0.0 0.0 0.0 0.95 0.97 247967.38 445.4667746215078 18.4359 14.1875 16 0 0 0 0 0 15 0 0 0 0 0 -0 LPE(14:0)+Na LPE(14:0)+Na LPE (14:0) (14:0) 448.24346347000005 C19 H40 O7 N1 P1 Na1 3764519.475 1573652.763 5.0 4.4543872569698015 11.434012762800327 1.0 57.41577328864671 0.0 3534616.584 0.0 0.0 0.0 0.0 0.0 3764519.475 0.0 0.0 0.0 0.0 0.0 1338225.432 0.0 0.0 0.0 0.0 0.0 1573652.763 0.0 0.0 0.0 0.0 4.996 5.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.85 1.0 -408 -407 -406 -405 -404 -403 -402 291 -401 -400 -399 -398 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 448.24346 448.244995 5.0 4.996 5.0 5.0 5.0 5.0 5.0 5.0 5.0 5.0 5.0 5.0 674792.9375 1 1 1 1 1 1 1 1 1 1 1 1 448.24346347000005 3.470000024208275E-6 448.24346347000005 448.24346347000005 448.24346347000005 448.24346347000005 448.24346347000005 0.0015315299999656418 448.24346347000005 448.24346347000005 448.24346347000005 448.24346347000005 1000000.0 0.007741328780002421 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.4167369404777586 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 12.835240921814025 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.540796642643684 0.0 0.0 0.0 0.0 1.0 1.0 95.91486073717388 57.41577328864671 10.1031 10.3566 0 9 0 0 0 0 0 8 0 0 0 0 -0 LPE(16:1)+H LPE(16:1)+H LPE (16:1) (16:1) 452.27716847000005 C21 H43 O7 N1 P1 4477966.895 1884071.972 4.957 6.159667036340401 19.12092042132734 0.99 36.912030293001266 0.0 4477966.895 0.0 0.0 0.0 0.0 0.0 4104168.361 0.0 0.0 0.0 0.0 0.0 1884071.972 0.0 0.0 0.0 0.0 0.0 1435278.159 0.0 0.0 0.0 0.0 4.954 4.956 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 1.0 0.88 -419 -418 -417 -416 -415 -414 -413 280 -412 -411 -410 -409 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 452.27717 452.276643 4.957 4.954 4.957 4.957 4.957 4.957 4.957 4.956 4.957 4.957 4.957 4.957 377447.8125 1 1 1 1 1 1 1 1 1 1 1 1 452.27716847000005 1.5299999631679384E-6 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 5.25470000070527E-4 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 1000000.0 0.0033828812724368703 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.161831807358593 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.55844094484175 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 72.79220472420874 0.0 0.0 0.0 0.0 0.99 0.98 36.912030293001266 679.2417749653748 11.7577 12.5817 0 11 0 0 0 0 0 10 0 0 0 0 -0 LPE(18:1)+H LPE(18:1)+H LPE (18:1) (18:1) 480.30846847000004 C23 H47 O7 N1 P1 6787757.207 3051369.295 4.893 3.8349642793857037 11.812053231022169 0.99 93.12983037407449 0.0 6787757.207 0.0 0.0 0.0 0.0 0.0 6429345.176 0.0 0.0 0.0 0.0 0.0 3051369.295 0.0 0.0 0.0 0.0 0.0 2580937.466 0.0 0.0 0.0 0.0 4.894 4.898 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -430 272 -429 -428 -427 -426 -425 -424 -423 -422 -421 -420 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 480.30802 480.30847 4.893 4.894 4.893 4.893 4.893 4.893 4.893 4.898 4.893 4.893 4.893 4.893 273762.78125 1 1 1 1 1 1 1 1 1 1 1 1 480.30846847000004 4.4847000003755966E-4 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 1.5299999631679384E-6 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 1000000.0 0.93371245663467 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.003185452815441046 1000000.0 1000000.0 1000000.0 1000000.0 0.0 14.112412569774174 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 70.21100780982177 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 93.12983037407449 1068.7584629212733 13.7875 14.6241 0 8 0 0 0 0 0 8 0 0 0 0 -0 LPE(18:3)+Na LPE(18:3)+Na LPE (18:3) (18:3) 498.25911347000005 C23 H42 O7 N1 P1 Na1 1302384.948 298079.68 4.797 19.459067881534615 4.1097766546579155 0.84 6.614166229631786 0.0 1302384.948 0.0 0.0 0.0 0.0 0.0 987328.629 0.0 0.0 0.0 0.0 0.0 281244.232 0.0 0.0 0.0 0.0 0.0 298079.68 0.0 0.0 0.0 0.0 4.793 4.803 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 1.0 0.73 -441 264 -440 -439 -438 -437 -436 -435 -434 -433 -432 -431 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 498.258445 498.25911 4.797 4.793 4.797 4.797 4.797 4.797 4.797 4.803 4.797 4.797 4.797 4.797 277815.09375 1 1 1 1 1 1 1 1 1 1 1 1 498.25911347000005 6.684700000505472E-4 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 3.470000024208275E-6 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 1000000.0 1.3416111857847544 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006964247979414434 1000000.0 1000000.0 1000000.0 1000000.0 0.0 14.466924899852845 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 48.22308299950949 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.84 0.89 6.614166229631786 329554.16 7.3039 8.2501 0 20 0 0 0 0 0 28 0 0 0 0 -0 LPS(18:3)+H LPS(18:3)+H LPS (18:3) (18:3) 520.2669984700001 C24 H43 O9 N1 P1 745619.855 343917.592 5.621 2.1944076757656963 2.4984691351092563 0.99 370.45206217686393 745619.855 0.0 0.0 0.0 0.0 0.0 722834.14 0.0 0.0 0.0 0.0 0.0 343917.592 0.0 0.0 0.0 0.0 0.0 331976.673 0.0 0.0 0.0 0.0 0.0 5.621 5.621 0.017 0.0 0.0 0.0 0.0 0.0 0.015 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.93 0.95 373 -452 -451 -450 -449 -448 -447 -446 -445 -444 -443 -442 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.267822 520.267 5.621 5.621 5.621 5.621 5.621 5.621 5.621 5.621 5.621 5.621 5.621 5.621 440534.75 1 1 1 1 1 1 1 1 1 1 1 1 8.235299999341805E-4 520.2669984700001 520.2669984700001 520.2669984700001 520.2669984700001 520.2669984700001 1.5299999631679384E-6 520.2669984700001 520.2669984700001 520.2669984700001 520.2669984700001 520.2669984700001 1.5828987853467844 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0029407976436471245 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.208309553682405 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 38.718441290954736 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 370.45206217686393 508.91082441050855 22.1856 12.9228 8 0 0 0 0 0 8 0 0 0 0 0 -0 MePC(27:0)+Na MePC(27:0)+Na MePC (27:0) (27:0) 700.48877847 C36 H72 O8 N1 P1 Na1 1678839.998 435102.068 4.5 10.075012904100383 0.13072065584465317 0.9 308.5432696038345 1678839.998 0.0 0.0 0.0 0.0 0.0 1455543.1 0.0 0.0 0.0 0.0 0.0 434298.451 0.0 0.0 0.0 0.0 0.0 435102.068 0.0 0.0 0.0 0.0 0.0 4.503 4.499 0.038 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.88 0.91 -463 -462 -461 -460 -459 -458 246 -457 -456 -455 -454 -453 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 700.48878 700.489327 4.503 4.5 4.5 4.5 4.5 4.5 4.499 4.5 4.5 4.5 4.5 4.5 357045.8125 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 700.48877847 700.48877847 700.48877847 700.48877847 700.48877847 5.485299999463678E-4 700.48877847 700.48877847 700.48877847 700.48877847 700.48877847 0.0021841891122221084 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7830675048706148 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.982030587291177 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 34.91015293645589 0.0 0.0 0.0 0.0 0.0 0.9 0.99 308.5432696038345 391.4045522836539 8.7523 8.9941 14 0 0 0 0 0 15 0 0 0 0 0 -1 MePC(28:0)+Na MePC(28:0)+Na MePC (28:0) (28:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 1661047.214 456341.803 4.482 1.1610405630950653 1.0992156275592688 0.95 -0.04012791399625589 1661047.214 0.0 0.0 0.0 0.0 0.0 1633995.583 0.0 0.0 0.0 0.0 0.0 449302.566 0.0 0.0 0.0 0.0 0.0 456341.803 0.0 0.0 0.0 0.0 0.0 4.476 4.478 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -474 -473 -472 -471 -470 -469 245 -468 -467 -466 -465 -464 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.50443 714.506369 4.476 4.482 4.482 4.482 4.482 4.482 4.478 4.482 4.482 4.482 4.482 4.482 451444.34375 1 1 1 1 1 1 1 1 1 1 1 1 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 0.0019405299998425107 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 0.0021413441100111264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.7159103884042444 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 8.88316029938619 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 44.41580149693095 0.0 0.0 0.0 0.0 0.0 0.95 0.92 -0.04012791399625589 -0.43961807390998203 4.3591 3.7378 13 0 0 0 0 0 14 0 0 0 0 0 -1 MePC(29:2)+Na MePC(29:2)+Na MePC (29:2) (29:2) 724.48877847 C38 H72 O8 N1 P1 Na1 1080904.313099995 374063.84 4.34 5.83958985639725 20.421324448796195 0.7111643351562991 1.8773255784963947 1080904.313099995 0.0 0.0 0.0 0.0 0.0 995178.4226999942 0.0 0.0 0.0 0.0 0.0 374063.84 0.0 0.0 0.0 0.0 0.0 279665.01999999996 0.0 0.0 0.0 0.0 0.0 4.339 4.344 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 0.83 215 -485 -484 -483 -482 -481 -480 -479 -478 -477 -476 -475 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 724.491516 724.48878 4.339 4.34 4.34 4.34 4.34 4.34 4.344 4.34 4.34 4.34 4.34 4.34 287063.03125 1 1 1 1 1 1 1 1 1 1 1 1 0.002737529999990329 724.48877847 724.48877847 724.48877847 724.48877847 724.48877847 1.5299999631679384E-6 724.48877847 724.48877847 724.48877847 724.48877847 724.48877847 3.7785678416876762 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002111833900863232 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.613958965310768 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 43.069794826553846 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7111643351562991 0.5115799779941024 1.8773255784963947 1.1692148228593082 2.5413 2.7107 11 0 0 0 0 0 12 0 0 0 0 0 -0 MePC(30:1)+Na MePC(30:1)+Na MePC (30:1) (30:1) 740.5200784700002 C39 H76 O8 N1 P1 Na1 1828559.12 442623.973 4.446 1.9206105851672242 1.3565497007884812 0.92 15.346746056606625 1828559.12 0.0 0.0 0.0 0.0 0.0 1779558.118 0.0 0.0 0.0 0.0 0.0 434213.128 0.0 0.0 0.0 0.0 0.0 442623.973 0.0 0.0 0.0 0.0 0.0 4.454 4.449 0.038 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.9 0.88 -496 -495 -494 -493 -492 -491 228 -490 -489 -488 -487 -486 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.52008 740.522583 4.454 4.446 4.446 4.446 4.446 4.446 4.449 4.446 4.446 4.446 4.446 4.446 480697.28125 1 1 1 1 1 1 1 1 1 1 1 1 1.5299998494811007E-6 740.5200784700002 740.5200784700002 740.5200784700002 740.5200784700002 740.5200784700002 0.0025045299998964765 740.5200784700002 740.5200784700002 740.5200784700002 740.5200784700002 740.5200784700002 0.0020661152802801197 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.382123014234974 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 8.172985216639983 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 40.86492608319991 0.0 0.0 0.0 0.0 0.0 0.92 0.95 15.346746056606625 36.9466286091545 4.8687 11.0504 24 0 0 0 0 0 27 0 0 0 0 0 -0 MePC(32:1)+NH4 MePC(32:1)+NH4 MePC (32:1) (32:1) 763.59598247 C41 H84 O8 N2 P1 1791809.481 377700.414 4.454643930977078 2.3480856161449473 0.3153104504833355 0.98 100.99325822348565 1791809.481 0.0 0.0 0.0 0.0 0.0 1733280.742 0.0 0.0 0.0 0.0 0.0 377700.414 0.0 0.0 0.0 0.0 0.0 376019.933 0.0 0.0 0.0 0.0 0.0 4.456 4.443 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 227 -506 -505 -504 -503 -502 221 -501 -500 -499 -498 -497 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 763.599479 763.599068 4.456 4.454643930977078 4.454643930977078 4.454643930977078 4.454643930977078 4.454643930977078 4.443 4.454643930977078 4.454643930977078 4.454643930977078 4.454643930977078 4.454643930977078 187952.953125 132377.234375 1 1 1 1 1 1 1 1 1 1 1 1 0.0034965300000067145 763.59598247 763.59598247 763.59598247 763.59598247 763.59598247 0.0030855300000212083 763.59598247 763.59598247 763.59598247 763.59598247 763.59598247 4.579031425357304 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.040788677332299 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.055654268041765 0.0 0.0 0.0 0.0 0.0 7.642351796685176 0.0 0.0 0.0 0.0 0.0 C C 40.278271340208825 0.0 0.0 0.0 0.0 0.0 38.21175898342588 0.0 0.0 0.0 0.0 0.0 0.98 0.79 100.99325822348565 167.23230568123762 11.5039 12.0861 21 0 0 0 0 0 23 0 0 0 0 0 -0 MePC(33:3)+Na MePC(33:3)+Na MePC (33:3) (33:3) 778.5357284700001 C42 H78 O8 N1 P1 Na1 1.77257028989E8 5.0805332601E7 4.43 9.521703254324807 4.51662708495451 0.87 5283.267385745525 1.77257028989E8 0.0 0.0 0.0 0.0 0.0 1.54893777105E8 0.0 0.0 0.0 0.0 0.0 4.7660589388E7 0.0 0.0 0.0 0.0 0.0 5.0805332601E7 0.0 0.0 0.0 0.0 0.0 4.428 4.435 0.021 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.81 0.82 -517 -516 -515 -514 -513 -512 272 -511 -510 -509 -508 -507 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 778.53573 778.537353 4.428 4.43 4.43 4.43 4.43 4.43 4.435 4.43 4.43 4.43 4.43 4.43 171698.265625 1 1 1 1 1 1 1 1 1 1 1 1 1.5299998494811007E-6 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 0.001624529999958213 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 0.001965227533600672 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.08664797330597 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.567601857062892 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 37.838009285314456 0.0 0.0 0.0 0.0 0.0 0.87 0.97 5283.267385745525 4315.511373788574 27.3179 24.8395 19 0 0 0 0 0 17 0 0 0 0 0 -1 MePC(33:3)+Na MePC(33:3)+Na MePC (33:3) (33:3) 778.5357284700001 C42 H78 O8 N1 P1 Na1 250733.64 253251.455 4.836 71.90125894887782 55.499033762088914 0.7 0.1120921062986016 81712.04460000109 0.0 0.0 0.0 0.0 0.0 250733.64 0.0 0.0 0.0 0.0 0.0 110501.26999999996 0.0 0.0 0.0 0.0 0.0 253251.455 0.0 0.0 0.0 0.0 0.0 4.836 4.859 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.82 1.0 289 -528 -527 -526 -525 -524 -523 -522 -521 -520 -519 -518 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 778.53692 778.53573 4.836 4.836 4.836 4.836 4.836 4.836 4.859 4.836 4.836 4.836 4.836 4.836 255787.796875 1 1 1 1 1 1 1 1 1 1 1 1 0.0011915299999145645 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 1.5299998494811007E-6 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 778.5357284700001 1.5304756819011918 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.001965227533600672 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.370397319342171 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 31.85198659671086 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 0.0 0.1120921062986016 1.6262 54.2126 3 0 0 0 0 0 10 0 0 0 0 0 -0 MePC(35:1)+Na MePC(35:1)+Na MePC (35:1) (35:1) 810.5983284700001 C44 H86 O8 N1 P1 Na1 3031021.91 948634.09 4.4 2.5281107909899667 4.930305467150147 0.95 113.95311130479766 3031021.91 0.0 0.0 0.0 0.0 0.0 2924557.338 0.0 0.0 0.0 0.0 0.0 884718.781 0.0 0.0 0.0 0.0 0.0 948634.09 0.0 0.0 0.0 0.0 0.0 4.399 4.401 0.026 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.78 0.8 -539 -538 -537 -536 -535 -534 223 -533 -532 -531 -530 -529 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 810.59833 810.595806 4.399 4.4 4.4 4.4 4.4 4.4 4.401 4.4 4.4 4.4 4.4 4.4 461378.875 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 0.0025224700000308076 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 0.0018874945943397209 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.111861832718007 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.349679301769831 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 36.748396508849154 0.0 0.0 0.0 0.0 0.0 0.95 0.95 113.95311130479766 261.3230535538487 19.3922 24.9562 19 0 0 0 0 0 18 0 0 0 0 0 -0 MePC(35:1e)+Na MePC(35:1e)+Na MePC (35:1e) (35:1e) 796.6190634700001 C44 H88 O7 N1 P1 Na1 1104135.889 338093.614 4.372 2.4552355421934084 1.7453732299697746 0.96 245.48282763244364 1066452.015 0.0 0.0 0.0 0.0 0.0 1104135.889 0.0 0.0 0.0 0.0 0.0 338093.614 0.0 0.0 0.0 0.0 0.0 329850.085 0.0 0.0 0.0 0.0 0.0 4.371 4.37 0.023 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.92 0.93 218 -550 -549 -548 -547 -546 -545 -544 -543 -542 -541 -540 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 796.61828 796.61906 4.371 4.372 4.372 4.372 4.372 4.372 4.37 4.372 4.372 4.372 4.372 4.372 264512.15625 1 1 1 1 1 1 1 1 1 1 1 1 7.834700001012607E-4 796.6190634700001 796.6190634700001 796.6190634700001 796.6190634700001 796.6190634700001 3.470000137895113E-6 796.6190634700001 796.6190634700001 796.6190634700001 796.6190634700001 796.6190634700001 0.9834939132494981 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004355908987138857 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.536803379063791 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 42.684016895318955 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.96 72.39157220482925 245.48282763244364 6.5543 12.9501 14 0 0 0 0 0 15 0 0 0 0 0 -0 PC(30:0)+H PC(30:0)+H PC (30:0) (30:0) 706.5381334700002 C38 H77 O8 N1 P1 4941341.135 1529045.094 4.502507533860946 4.276489860216699 0.6743671579449081 0.99 913.956232057047 4941341.135 0.0 0.0 0.0 0.0 0.0 4651266.905 0.0 0.0 0.0 0.0 0.0 1529045.094 0.0 0.0 0.0 0.0 0.0 1514531.81 0.0 0.0 0.0 0.0 0.0 4.503 4.504 0.028 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.89 0.86 250 -560 -559 -558 -557 -556 253 -555 -554 -553 -552 -551 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 706.537839 706.537699 4.503 4.502507533860946 4.502507533860946 4.502507533860946 4.502507533860946 4.502507533860946 4.504 4.502507533860946 4.502507533860946 4.502507533860946 4.502507533860946 4.502507533860946 1124360.75 1119957.75 1 1 1 1 1 1 1 1 1 1 1 1 2.944700001989986E-4 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 4.344700001865931E-4 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 0.4167786369191096 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6149278851415892 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 18.819877554921867 0.0 0.0 0.0 0.0 0.0 18.243483635025218 0.0 0.0 0.0 0.0 0.0 C C 46.93236297985505 0.0 0.0 0.0 0.0 0.0 45.494971658417015 0.0 0.0 0.0 0.0 0.0 0.99 0.99 913.956232057047 1837.7061065667465 10.8241 11.7081 16 0 0 0 0 0 14 0 0 0 0 0 -0 PC(30:1)+H PC(30:1)+H PC (30:1) (30:1) 704.5224834700001 C38 H75 O8 N1 P1 1638804.694 299666.601 4.367497459698145 135.95157061057083 98.56811423798895 0.87 121.80198139281404 1638804.694 0.0 0.0 0.0 0.0 0.0 32317.17839999983 0.0 0.0 0.0 0.0 0.0 299666.601 0.0 0.0 0.0 0.0 0.0 53509.37000000005 0.0 0.0 0.0 0.0 0.0 4.365 4.368 0.043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 0.89 217 -570 -569 -568 -567 -566 213 -565 -564 -563 -562 -561 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 704.521729 704.521729 4.365 4.367497459698145 4.367497459698145 4.367497459698145 4.367497459698145 4.367497459698145 4.368 4.367497459698145 4.367497459698145 4.367497459698145 4.367497459698145 4.367497459698145 296937.4375 303135.875 1 1 1 1 1 1 1 1 1 1 1 1 7.544700000607918E-4 704.5224834700001 704.5224834700001 704.5224834700001 704.5224834700001 704.5224834700001 7.544700000607918E-4 704.5224834700001 704.5224834700001 704.5224834700001 704.5224834700001 704.5224834700001 1.0708955608411304 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0708955608411304 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 14.266831784712995 0.0 0.0 0.0 0.0 0.0 18.084456924713095 0.0 0.0 0.0 0.0 0.0 C C 47.538136511895 0.0 0.0 0.0 0.0 0.0 45.0983963209803 0.0 0.0 0.0 0.0 0.0 0.87 0.0 121.80198139281404 0.7402689963644217 12.1493 1.1962 15 0 0 0 0 0 3 0 0 0 0 0 -0 PC(30:3)+H PC(30:3)+H PC (30:3) (30:3) 700.4911834700001 C38 H71 O8 N1 P1 1666745.22 453622.582 4.501 9.253208087905767 0.6089268724319821 0.98 307.2829708055666 1666745.22 0.0 0.0 0.0 0.0 0.0 1462029.309 0.0 0.0 0.0 0.0 0.0 453622.582 0.0 0.0 0.0 0.0 0.0 449732.947 0.0 0.0 0.0 0.0 0.0 4.497 4.501 0.028 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.92 0.91 245 -581 -580 -579 -578 -577 -576 -575 -574 -573 -572 -571 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 700.491704 700.49118 4.497 4.501 4.501 4.501 4.501 4.501 4.501 4.501 4.501 4.501 4.501 4.501 401790.0625 1 1 1 1 1 1 1 1 1 1 1 1 5.205299999033741E-4 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 3.470000137895113E-6 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 0.7430928642454024 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004953667112133928 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 13.437286259569582 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 44.77402959508435 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.98 307.2829708055666 412.32672025240385 8.97 9.0176 14 0 0 0 0 0 15 0 0 0 0 0 -0 PC(31:0)+H PC(31:0)+H PC (31:0) (31:0) 720.5537834700001 C39 H79 O8 N1 P1 2844407.761 717275.503 4.490912952602869 4.611782450422319 4.2095900241338615 0.94 286.8259209446521 2844407.761 0.0 0.0 0.0 0.0 0.0 2664752.788 0.0 0.0 0.0 0.0 0.0 717275.503 0.0 0.0 0.0 0.0 0.0 675808.55 0.0 0.0 0.0 0.0 0.0 4.487 4.494 0.027 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.92 0.85 247 -591 -590 -589 -588 -587 249 -586 -585 -584 -583 -582 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 720.554343 720.553673 4.487 4.490912952602869 4.490912952602869 4.490912952602869 4.490912952602869 4.490912952602869 4.494 4.490912952602869 4.490912952602869 4.490912952602869 4.490912952602869 4.490912952602869 680154.0625 769796.875 1 1 1 1 1 1 1 1 1 1 1 1 5.595299999185954E-4 720.5537834700001 720.5537834700001 720.5537834700001 720.5537834700001 720.5537834700001 1.1047000009511976E-4 720.5537834700001 720.5537834700001 720.5537834700001 720.5537834700001 720.5537834700001 0.7765277384625532 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1533126362380958 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.814100558230443 0.0 0.0 0.0 0.0 0.0 12.58079612612308 0.0 0.0 0.0 0.0 0.0 C C 42.697528842179665 0.0 0.0 0.0 0.0 0.0 41.920141254682214 0.0 0.0 0.0 0.0 0.0 0.94 0.99 286.8259209446521 322.4843579697764 9.4887 9.38 17 0 0 0 0 0 16 0 0 0 0 0 -1 PC(31:1)+H PC(31:1)+H PC (31:1) (31:1) 718.5381334700002 C39 H77 O8 N1 P1 125873.12430000158 103580.61000000002 4.351935624341827 4.665943406763745 21.043660002391064 0.0 0.754841677387203 125873.12430000158 0.0 0.0 0.0 0.0 0.0 117832.49549999935 0.0 0.0 0.0 0.0 0.0 76747.57 0.0 0.0 0.0 0.0 0.0 103580.61000000002 0.0 0.0 0.0 0.0 0.0 4.371 4.353 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.79 0.87 214 -601 -600 -599 -598 -597 250 -596 -595 -594 -593 -592 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 718.53833 718.539163 4.371 4.351935624341827 4.351935624341827 4.351935624341827 4.351935624341827 4.351935624341827 4.353 4.351935624341827 4.351935624341827 4.351935624341827 4.351935624341827 4.351935624341827 289221.125 435906.84375 1 1 1 1 1 1 1 1 1 1 1 1 1.9652999981190078E-4 718.5381334700002 718.5381334700002 718.5381334700002 718.5381334700002 718.5381334700002 0.0010295299998688279 718.5381334700002 718.5381334700002 718.5381334700002 718.5381334700002 718.5381334700002 0.27351366706566893 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4328119161845596 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.144822711504027 0.0 0.0 0.0 0.0 0.0 9.087446552375827 0.0 0.0 0.0 0.0 0.0 C C 47.74270002868836 0.0 0.0 0.0 0.0 0.0 45.704628621000666 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.754841677387203 0.9003237869407135 1.1622 1.3218 5 0 0 0 0 0 5 0 0 0 0 0 -1 PC(31:3)+H PC(31:3)+H PC (31:3) (31:3) 714.5068334700001 C39 H73 O8 N1 P1 1984792.612 459252.012 4.474 1.5500918298538848 1.6997619037683505 0.92 -0.2681652523798152 1984792.612 0.0 0.0 0.0 0.0 0.0 1941754.497 0.0 0.0 0.0 0.0 0.0 448343.502 0.0 0.0 0.0 0.0 0.0 459252.012 0.0 0.0 0.0 0.0 0.0 4.475 4.479 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 244 -612 -611 -610 -609 -608 -607 -606 -605 -604 -603 -602 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.506923 714.50683 4.475 4.474 4.474 4.474 4.474 4.474 4.479 4.474 4.474 4.474 4.474 4.474 393217.8125 1 1 1 1 1 1 1 1 1 1 1 1 8.952999996836297E-5 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 3.470000024208275E-6 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 0.12530321023461852 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004856496623490963 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.064228341225828 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 47.54171656166044 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.86 -0.2681652523798152 -0.4396812744862273 3.8426 3.7612 13 0 0 0 0 0 14 0 0 0 0 0 -0 PC(32:0)+H PC(32:0)+H PC (32:0) (32:0) 734.56943347 C40 H81 O8 N1 P1 2.1053606959E7 5522897.614 4.481 5.9598774317010506 7.482228068276851 0.92 1433.9563484673106 2.1053606959E7 0.0 0.0 0.0 0.0 0.0 1.9350853985E7 0.0 0.0 0.0 0.0 0.0 5522897.614 0.0 0.0 0.0 0.0 0.0 4967859.537 0.0 0.0 0.0 0.0 0.0 4.475 4.478 0.026 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.85 0.85 -623 -622 -621 -620 -619 -618 236 -617 -616 -615 -614 -613 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 734.56943 734.568484 4.475 4.481 4.481 4.481 4.481 4.481 4.478 4.481 4.481 4.481 4.481 4.481 3501511.75 1 1 1 1 1 1 1 1 1 1 1 1 3.470000024208275E-6 734.56943347 734.56943347 734.56943347 734.56943347 734.56943347 9.494700000232115E-4 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4.314 4.3357399376995165 4.3357399376995165 4.3357399376995165 4.3357399376995165 4.3357399376995165 553497.25 1 1 1 1 1 1 1 1 1 1 1 1 3.5300000718052615E-6 794.50966647 794.50966647 794.50966647 794.50966647 794.50966647 0.0033794699999134536 794.50966647 794.50966647 794.50966647 794.50966647 794.50966647 0.004442991974520616 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.253529116805352 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 8.118869280533962 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 40.39238448026848 0.0 0.0 0.0 0.0 0.0 0.0 0.6 0.0 0.8519808995963942 1.2874 5.8951 4 0 0 0 0 0 11 0 0 0 0 0 -1 PC(34:3)+H PC(34:3)+H PC (34:3) (34:3) 756.55378347 C42 H79 O8 N1 P1 2108504.664 343471.003 4.799 67.06122056097794 18.691671341210956 0.98 0.8947016750855974 752046.983 0.0 0.0 0.0 0.0 0.0 2108504.664 0.0 0.0 0.0 0.0 0.0 343471.003 0.0 0.0 0.0 0.0 0.0 263277.065 0.0 0.0 0.0 0.0 0.0 4.834 4.8 0.0 0.0 0.0 0.0 0.0 0.0 0.064 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.062 0.0 0.0 0.0 0.0 0.0 1.0 0.81 -748 -747 -746 -745 -744 -743 315 -742 -741 -740 -739 -738 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 756.55378 756.552831 4.834 4.799 4.799 4.799 4.799 4.799 4.8 4.799 4.799 4.799 4.799 4.799 229065.859375 1 1 1 1 1 1 1 1 1 1 1 1 3.470000024208275E-6 756.55378347 756.55378347 756.55378347 756.55378347 756.55378347 9.524700000156372E-4 756.55378347 756.55378347 756.55378347 756.55378347 756.55378347 0.004586587365002415 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.258958742691168 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 14.759139390221526 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 49.17854178965159 0.0 0.0 0.0 0.0 0.0 0.99 0.98 0.34803262613667435 0.8947016750855974 1.2101 1.2466 4 0 0 0 0 0 5 0 0 0 0 0 -1 PC(34:4)+H PC(34:4)+H PC (34:4) (34:4) 754.5381334700002 C42 H77 O8 N1 P1 1.8886864032600094E7 7198717.81 4.316352087736812 1.1914140530871131 8.63615042992494 0.831917490404252 1.1224031500729879 1.8886864032600094E7 0.0 0.0 0.0 0.0 0.0 1.8571295164800033E7 0.0 0.0 0.0 0.0 0.0 7198717.81 0.0 0.0 0.0 0.0 0.0 6370112.68 0.0 0.0 0.0 0.0 0.0 4.307 4.323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.82 0.79 234 -758 -757 -756 -755 -754 187 -753 -752 -751 -750 -749 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 754.536781 754.537937 4.307 4.316352087736812 4.316352087736812 4.316352087736812 4.316352087736812 4.316352087736812 4.323 4.316352087736812 4.316352087736812 4.316352087736812 4.316352087736812 4.316352087736812 1.0390324E7 1347710.5 1 1 1 1 1 1 1 1 1 1 1 1 0.0013524700001426027 754.5381334700002 754.5381334700002 754.5381334700002 754.5381334700002 754.5381334700002 1.964700001053643E-4 754.5381334700002 754.5381334700002 754.5381334700002 754.5381334700002 754.5381334700002 1.7924475121261392 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.26038445426453166 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.10392979546827 0.0 0.0 0.0 0.0 0.0 17.922547833516926 0.0 0.0 0.0 0.0 0.0 C C 47.64072268196578 0.0 0.0 0.0 0.0 0.0 44.694633001289105 0.0 0.0 0.0 0.0 0.0 0.831917490404252 0.0 1.1224031500729879 1.0173163539125514 165.1458 39.3843 17 0 0 0 0 0 14 0 0 0 0 0 -1 PC(34:5)+H PC(34:5)+H PC (34:5) (34:5) 752.5224834700001 C42 H75 O8 N1 P1 1.5912605827499935E7 3980681.02 4.318481947033297 36.856961029934155 2.865592813814091 0.6956341915903412 3.3264095390175976 9333114.817500053 0.0 0.0 0.0 0.0 0.0 1.5912605827499935E7 0.0 0.0 0.0 0.0 0.0 3980681.02 0.0 0.0 0.0 0.0 0.0 3822565.39 0.0 0.0 0.0 0.0 0.0 4.307 4.323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 0.82 197 -768 -767 -766 -765 -764 195 -763 -762 -761 -760 -759 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 752.523521 752.522644 4.307 4.318481947033297 4.318481947033297 4.318481947033297 4.318481947033297 4.318481947033297 4.323 4.318481947033297 4.318481947033297 4.318481947033297 4.318481947033297 4.318481947033297 1680971.625 1899080.125 1 1 1 1 1 1 1 1 1 1 1 1 0.0010375299998486298 752.5224834700001 752.5224834700001 752.5224834700001 752.5224834700001 752.5224834700001 1.6052999990279204E-4 752.5224834700001 752.5224834700001 752.5224834700001 752.5224834700001 752.5224834700001 1.3787362140522565 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.21332252979680136 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 16.438679538182615 0.0 0.0 0.0 0.0 0.0 16.850128584246256 0.0 0.0 0.0 0.0 0.0 C C 40.99421331217611 0.0 0.0 0.0 0.0 0.0 42.020270783656514 0.0 0.0 0.0 0.0 0.0 0.5591103637499426 0.6956341915903412 0.7909598598313538 3.3264095390175976 46.829 7.8497 13 0 0 0 0 0 18 0 0 0 0 0 -1 PC(34:6)+H PC(34:6)+H PC (34:6) (34:6) 750.5068334700001 C42 H73 O8 N1 P1 1.445143032420001E7 4092073.84 4.331977301542283 30.763876936304708 2.0619705523876237 0.7720427030768762 2.244395233710496 1.445143032420001E7 0.0 0.0 0.0 0.0 0.0 9287433.204900011 0.0 0.0 0.0 0.0 0.0 4092073.84 0.0 0.0 0.0 0.0 0.0 3974461.07 0.0 0.0 0.0 0.0 0.0 4.339 4.323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 0.82 203 -778 -777 -776 -775 -774 238 -773 -772 -771 -770 -769 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 750.506974 750.506424 4.339 4.331977301542283 4.331977301542283 4.331977301542283 4.331977301542283 4.331977301542283 4.323 4.331977301542283 4.331977301542283 4.331977301542283 4.331977301542283 4.331977301542283 2962299.75 6300409.0 1 1 1 1 1 1 1 1 1 1 1 1 1.405299999532872E-4 750.5068334700001 750.5068334700001 750.5068334700001 750.5068334700001 750.5068334700001 4.0947000002233835E-4 750.5068334700001 750.5068334700001 750.5068334700001 750.5068334700001 750.5068334700001 0.18724679601322322 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5455913014530946 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.301862012167625 0.0 0.0 0.0 0.0 0.0 8.345326735551652 0.0 0.0 0.0 0.0 0.0 C C 48.13431923233823 0.0 0.0 0.0 0.0 0.0 27.623698464894797 0.0 0.0 0.0 0.0 0.0 0.7720427030768762 0.4293804957708387 2.244395233710496 0.7951421248362016 23.5562 38.6637 15 0 0 0 0 0 11 0 0 0 0 0 -0 PC(35:3)+H PC(35:3)+H PC (35:3) (35:3) 770.56943347 C43 H81 O8 N1 P1 6716054.644 1681642.823 4.429505308725933 1.0991749342727601 3.1010868966823546 0.91 502.0643281088957 6612460.883 0.0 0.0 0.0 0.0 0.0 6716054.644 0.0 0.0 0.0 0.0 0.0 1609475.201 0.0 0.0 0.0 0.0 0.0 1681642.823 0.0 0.0 0.0 0.0 0.0 4.427 4.434 0.029 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.84 0.82 219 -788 -787 -786 -785 -784 216 -783 -782 -781 -780 -779 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 770.568249 770.568168 4.427 4.429505308725933 4.429505308725933 4.429505308725933 4.429505308725933 4.429505308725933 4.434 4.429505308725933 4.429505308725933 4.429505308725933 4.429505308725933 4.429505308725933 687692.25 800318.125 1 1 1 1 1 1 1 1 1 1 1 1 0.0011844699999983277 770.56943347 770.56943347 770.56943347 770.56943347 770.56943347 0.001265470000021196 770.56943347 770.56943347 770.56943347 770.56943347 770.56943347 1.5371359783432699 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6422530469740773 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.59261730234401 0.0 0.0 0.0 0.0 0.0 11.877492600261268 0.0 0.0 0.0 0.0 0.0 C C 43.87186359686787 0.0 0.0 0.0 0.0 0.0 39.57668199713771 0.0 0.0 0.0 0.0 0.0 0.94 0.91 657.01921319873 502.0643281088957 18.8795 18.1768 22 0 0 0 0 0 18 0 0 0 0 0 -0 PC(35:4)+H PC(35:4)+H PC (35:4) (35:4) 768.55378347 C43 H79 O8 N1 P1 5468898.596 1370149.292 4.310335060307518 111.26806650533341 84.3207889796467 0.76 98.26557848815628 5468898.596 0.0 0.0 0.0 0.0 0.0 652600.6593000004 0.0 0.0 0.0 0.0 0.0 1370149.292 0.0 0.0 0.0 0.0 0.0 346573.75 0.0 0.0 0.0 0.0 0.0 4.305 4.323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.84 228 -798 -797 -796 -795 -794 231 -793 -792 -791 -790 -789 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 768.552382 768.551831 4.305 4.310335060307518 4.310335060307518 4.310335060307518 4.310335060307518 4.310335060307518 4.323 4.310335060307518 4.310335060307518 4.310335060307518 4.310335060307518 4.310335060307518 2061482.25 1861233.5 1 1 1 1 1 1 1 1 1 1 1 1 0.0014014700000188896 768.55378347 768.55378347 768.55378347 768.55378347 768.55378347 0.0019524699999919903 768.55378347 768.55378347 768.55378347 768.55378347 768.55378347 1.823515842562494 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.540446800192226 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.349245309693718 0.0 0.0 0.0 0.0 0.0 15.98472501560746 0.0 0.0 0.0 0.0 0.0 C C 48.25248206906166 0.0 0.0 0.0 0.0 0.0 39.86215714615328 0.0 0.0 0.0 0.0 0.0 0.76 0.6187489317336317 98.26557848815628 3.723894572574741 6.8923 1.2995 13 0 0 0 0 0 7 0 0 0 0 0 -0 PC(25:0_11:4)+Na PC(36:4)+Na PC (25:0_11:4) (25:0) (11:4) 804.55137847 C44 H80 O8 N1 P1 Na1 5188753.246 831041.122 4.295241443520485 1.210020315593718 13.788467021927065 0.65 38.98010366392238 5100715.158 0.0 0.0 0.0 0.0 0.0 5188753.246 0.0 0.0 0.0 0.0 0.0 831041.122 0.0 0.0 0.0 0.0 0.0 683385.737 0.0 0.0 0.0 0.0 0.0 4.417 4.394 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -809 -808 -807 -806 -805 -804 194 -803 -802 -801 -800 -799 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 804.55138 804.548858 4.417 4.295241443520485 4.295241443520485 4.295241443520485 4.295241443520485 4.295241443520485 4.394 4.295241443520485 4.295241443520485 4.295241443520485 4.295241443520485 4.295241443520485 310050.53125 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 804.55137847 804.55137847 804.55137847 804.55137847 804.55137847 0.002520470000035857 804.55137847 804.55137847 804.55137847 804.55137847 804.55137847 0.001901680867264823 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.1327645039015244 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 15.001462949679514 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 37.22447382054471 0.0 0.0 0.0 0.0 0.0 0.58 0.65 52.24163239989892 38.98010366392238 11.2636 13.2425 40 0 0 0 0 0 40 0 0 0 0 0 -0 PC(36:5)+H PC(36:5)+H PC (36:5) (36:5) 780.55378347 C44 H79 O8 N1 P1 8.649396930810003E7 2.159701655E7 4.304 12.021483817310612 4.417574410139162 0.5382016644866557 57.59077592959215 7.294122416910027E7 0.0 0.0 0.0 0.0 0.0 8.649396930810003E7 0.0 0.0 0.0 0.0 0.0 2.159701655E7 0.0 0.0 0.0 0.0 0.0 2.028863576E7 0.0 0.0 0.0 0.0 0.0 4.296 4.291 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.79 0.83 -820 -819 -818 -817 -816 -815 217 -814 -813 -812 -811 -810 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.55378 780.551652 4.296 4.304 4.304 4.304 4.304 4.304 4.291 4.304 4.304 4.304 4.304 4.304 2.1231868E7 1 1 1 1 1 1 1 1 1 1 1 1 3.470000024208275E-6 780.55378347 780.55378347 780.55378347 780.55378347 780.55378347 0.002131469999994806 780.55378347 780.55378347 780.55378347 780.55378347 780.55378347 0.004445561725141061 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.7307150962989697 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 16.389855476899257 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 40.77078476840612 0.0 0.0 0.0 0.0 0.0 0.8842430963776199 0.5382016644866557 2.104974406231161 57.59077592959215 54.5439 17.0997 17 0 0 0 0 0 18 0 0 0 0 0 -0 PC(36:6)+H PC(36:6)+H PC (36:6) (36:6) 778.5381334700002 C44 H77 O8 N1 P1 2.01898336948E8 6.1599457337E7 4.392272343167362 8.27030024335539 18.326024632905906 0.98 526.0134286824765 1.79589012508E8 0.0 0.0 0.0 0.0 0.0 2.01898336948E8 0.0 0.0 0.0 0.0 0.0 4.7466228155E7 0.0 0.0 0.0 0.0 0.0 6.1599457337E7 0.0 0.0 0.0 0.0 0.0 4.429 4.434 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.82 1.0 188 -830 -829 -828 -827 -826 186 -825 -824 -823 -822 -821 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 778.538696 778.537666 4.429 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.434 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 1355271.625 5818708.5 1 1 1 1 1 1 1 1 1 1 1 1 5.625299997973343E-4 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 4.6747000021696294E-4 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 0.7225464953015183 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6004458614421566 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.280512722141058 0.0 0.0 0.0 0.0 0.0 20.396616538185786 0.0 0.0 0.0 0.0 0.0 C C 43.093547935513875 0.0 0.0 0.0 0.0 0.0 50.86438039447828 0.0 0.0 0.0 0.0 0.0 0.88 0.98 475.70713683076394 526.0134286824765 31.3012 42.7208 19 0 0 0 0 0 15 0 0 0 0 0 -0 PC(36:6)+Na PC(36:6)+Na PC (36:6) (36:6) 800.5200784700002 C44 H76 O8 N1 P1 Na1 2739525.77 529554.194 4.392272343167362 122.66525404611085 36.591453176150736 0.95 122.9574200071757 2739525.77 0.0 0.0 0.0 0.0 0.0 194568.08219999366 0.0 0.0 0.0 0.0 0.0 529554.194 0.0 0.0 0.0 0.0 0.0 311848.99 0.0 0.0 0.0 0.0 0.0 4.417 4.392 0.04 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.76 0.9 210 -840 -839 -838 -837 -836 204 -835 -834 -833 -832 -831 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 800.517821 800.516907 4.417 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.392 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 4.392272343167362 289991.21875 528443.875 1 1 1 1 1 1 1 1 1 1 1 1 0.002257470000131434 800.5200784700002 800.5200784700002 800.5200784700002 800.5200784700002 800.5200784700002 0.0031714700002112295 800.5200784700002 800.5200784700002 800.5200784700002 800.5200784700002 800.5200784700002 2.820004220813599 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.961761966386558 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.899517041577027 0.0 0.0 0.0 0.0 0.0 7.323207144156129 0.0 0.0 0.0 0.0 0.0 C C 63.70131872383718 0.0 0.0 0.0 0.0 0.0 48.17899436944823 0.0 0.0 0.0 0.0 0.0 0.95 0.0 122.9574200071757 0.0 8.3051 3.1543 34 0 0 0 0 0 3 0 0 0 0 0 -0 PC(38:4e)+H PC(38:4e)+H PC (38:4e) (38:4e) 796.62146847 C46 H87 O7 N1 P1 1099473.323 329848.784 4.368 4.419303308990206 2.2972325785423973 0.96 259.6861264122309 1032840.244 0.0 0.0 0.0 0.0 0.0 1099473.323 0.0 0.0 0.0 0.0 0.0 319304.019 0.0 0.0 0.0 0.0 0.0 329848.784 0.0 0.0 0.0 0.0 0.0 4.371 4.37 0.023 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.93 0.93 -851 -850 -849 -848 -847 -846 214 -845 -844 -843 -842 -841 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 796.62147 796.618578 4.371 4.368 4.368 4.368 4.368 4.368 4.37 4.368 4.368 4.368 4.368 4.368 301419.09375 1 1 1 1 1 1 1 1 1 1 1 1 1.5300000768547761E-6 796.62146847 796.62146847 796.62146847 796.62146847 796.62146847 0.0028904700000111916 796.62146847 796.62146847 796.62146847 796.62146847 796.62146847 0.001920611152738968 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.628410875698166 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 12.285442470193992 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 40.9360010736864 0.0 0.0 0.0 0.0 0.0 0.99 0.96 64.26883870173513 259.6861264122309 6.353 12.7303 14 0 0 0 0 0 15 0 0 0 0 0 -1 PC(38:5)+H PC(38:5)+H PC (38:5) (38:5) 808.5850834700001 C46 H83 O8 N1 P1 2263139.2203000127 739800.77 4.284 132.9323909370201 109.73542220946639 0.8638724341001107 2.4384456543460713 70025.32500000222 0.0 0.0 0.0 0.0 0.0 2263139.2203000127 0.0 0.0 0.0 0.0 0.0 93333.25 0.0 0.0 0.0 0.0 0.0 739800.77 0.0 0.0 0.0 0.0 0.0 4.286 4.28 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 0.75 -862 -861 -860 -859 -858 -857 183 -856 -855 -854 -853 -852 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.58508 808.581432 4.286 4.284 4.284 4.284 4.284 4.284 4.28 4.284 4.284 4.284 4.284 4.284 591389.25 1 1 1 1 1 1 1 1 1 1 1 1 3.470000137895113E-6 808.5850834700001 808.5850834700001 808.5850834700001 808.5850834700001 808.5850834700001 0.0036514700001362144 808.5850834700001 808.5850834700001 808.5850834700001 808.5850834700001 808.5850834700001 0.004291447132568648 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.515876034301949 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 12.624835154921598 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 42.066882549068154 0.0 0.0 0.0 0.0 0.0 0.0 0.8638724341001107 0.0 2.4384456543460713 1.1468 22.5454 3 0 0 0 0 0 18 0 0 0 0 0 -0 PC(38:6)+H PC(38:6)+H PC (38:6) (38:6) 806.56943347 C46 H81 O8 N1 P1 6031236.985200029 1487928.49 4.288 99.69772720606235 66.17335146893953 0.736618447856192 73.4365664882014 1043654.8239000076 0.0 0.0 0.0 0.0 0.0 6031236.985200029 0.0 0.0 0.0 0.0 0.0 539337.69 0.0 0.0 0.0 0.0 0.0 1487928.49 0.0 0.0 0.0 0.0 0.0 4.286 4.291 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 0.78 -873 -872 -871 -870 -869 -868 218 -867 -866 -865 -864 -863 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 806.56943 806.566447 4.286 4.288 4.288 4.288 4.288 4.288 4.291 4.288 4.288 4.288 4.288 4.288 2756157.5 1 1 1 1 1 1 1 1 1 1 1 1 3.470000024208275E-6 806.56943347 806.56943347 806.56943347 806.56943347 806.56943347 0.0029864699999961886 806.56943347 806.56943347 806.56943347 806.56943347 806.56943347 0.004302171493506442 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.702681847423702 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 15.018277996909498 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 50.04201075361841 0.0 0.0 0.0 0.0 0.0 0.0 0.736618447856192 3.1845403521509867 73.4365664882014 1.3918 29.3491 6 0 0 0 0 0 22 0 0 0 0 0 -1 PE(14:0e)+Na PE(14:0e)+Na PE (14:0e) (14:0e) 448.24346347 C19 H40 O7 N1 P1 Na1 3764068.048 1573755.538 4.957935894721071 3.826015467397474 11.417751277708673 1.0 1566482.0 0.0 3565766.593 0.0 0.0 0.0 0.0 0.0 3764068.048 0.0 0.0 0.0 0.0 0.0 1338622.664 0.0 0.0 0.0 0.0 0.0 1573755.538 0.0 0.0 0.0 0.0 4.996 5.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.85 1.0 -883 285 -882 -881 -880 -879 -878 273 -877 -876 -875 -874 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 448.245087 448.245018 4.957935894721071 4.996 4.957935894721071 4.957935894721071 4.957935894721071 4.957935894721071 4.957935894721071 5.0 4.957935894721071 4.957935894721071 4.957935894721071 4.957935894721071 534496.125 430443.15625 1 1 1 1 1 1 1 1 1 1 1 1 448.24346347 0.0016235300000175812 448.24346347 448.24346347 448.24346347 448.24346347 448.24346347 0.0015545300000212592 448.24346347 448.24346347 448.24346347 448.24346347 1000000.0 3.6219825437035973 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.468048341379329 1000000.0 1000000.0 1000000.0 1000000.0 0.0 15.015571394900517 0.0 0.0 0.0 0.0 0.0 26.57322291213511 0.0 0.0 0.0 0.0 C C 0.0 49.3933269569096 0.0 0.0 0.0 0.0 0.0 64.81273881008565 0.0 0.0 0.0 0.0 1.0 1.0 47.662925410777895 1566482.0 10.1031 10.3566 0 9 0 0 0 0 0 8 0 0 0 0 -0 PE(16:0e)+Na PE(16:0e)+Na PE (16:0e) (16:0e) 476.2747634700001 C21 H44 O7 N1 P1 Na1 2141676.434 509874.256 4.55 11.547344287963915 4.290363424703558 0.83 17.10389583117116 0.0 2141676.434 0.0 0.0 0.0 0.0 0.0 1818333.488 0.0 0.0 0.0 0.0 0.0 509874.256 0.0 0.0 0.0 0.0 0.0 479848.588 0.0 0.0 0.0 0.0 4.535 4.547 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -894 -893 -892 -891 -890 -889 -888 251 -887 -886 -885 -884 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 476.27476 476.276764 4.55 4.535 4.55 4.55 4.55 4.55 4.55 4.547 4.55 4.55 4.55 4.55 259413.078125 1 1 1 1 1 1 1 1 1 1 1 1 476.2747634700001 3.470000081051694E-6 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 0.002000529999918399 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 1000000.0 0.007285710575488564 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.2003695206168725 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 19.09198046944913 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.5966572768824 0.0 0.0 0.0 0.0 0.83 0.76 17.10389583117116 8.89083262113339 3.6949 2.6662 0 11 0 0 0 0 0 10 0 0 0 0 -0 PE(16:0e)+H PE(16:0e)+H PE (16:0e) (16:0e) 454.2928184700001 C21 H45 O7 N1 P1 610769.32 209984.45 4.812815388903811 0.807534142666109 6.177675841972338 0.98 53.45125920753272 0.0 610769.32 0.0 0.0 0.0 0.0 0.0 603833.78 0.0 0.0 0.0 0.0 0.0 192406.884 0.0 0.0 0.0 0.0 0.0 209984.45 0.0 0.0 0.0 0.0 4.798 4.801 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -905 -904 -903 -902 -901 -900 -899 279 -898 -897 -896 -895 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 454.29282 454.292541 4.812815388903811 4.798 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 4.801 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 420069.21875 1 1 1 1 1 1 1 1 1 1 1 1 454.2928184700001 1.5299999063245195E-6 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 2.774700000713892E-4 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 1000000.0 0.0033678716548444744 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6107734676631529 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 48.035546457970796 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 67.94278141155701 0.0 0.0 0.0 0.0 0.98 0.99 53.45125920753272 29.96861173738368 9.8408 8.1874 0 12 0 0 0 0 0 12 0 0 0 0 -0 PE(16:0e)+Na PE(16:0e)+Na PE (16:0e) (16:0e) 476.2747634700001 C21 H44 O7 N1 P1 Na1 1.5895056222E7 5610105.094 4.812815388903811 6.0758656927191925 9.989124693721498 0.99 11.194873066040923 0.0 1.4585523398E7 0.0 0.0 0.0 0.0 0.0 1.5895056222E7 0.0 0.0 0.0 0.0 0.0 4869865.198 0.0 0.0 0.0 0.0 0.0 5610105.094 0.0 0.0 0.0 0.0 4.8 4.805 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -916 -915 -914 -913 -912 -911 -910 270 -909 -908 -907 -906 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 476.27476 476.276489 4.812815388903811 4.8 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 4.805 4.812815388903811 4.812815388903811 4.812815388903811 4.812815388903811 2251775.25 1 1 1 1 1 1 1 1 1 1 1 1 476.2747634700001 3.470000081051694E-6 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 0.0017255299999305862 476.2747634700001 476.2747634700001 476.2747634700001 476.2747634700001 1000000.0 0.007285710575488564 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.622971721950737 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 29.725931525003947 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 72.85767530638225 0.0 0.0 0.0 0.0 0.97 0.99 166.87990272050072 11.194873066040923 12.5536 12.9012 0 11 0 0 0 0 0 11 0 0 0 0 -0 PE(16:1e)+H PE(16:1e)+H PE (16:1e) (16:1e) 452.27716847000005 C21 H43 O7 N1 P1 1444129.509 504206.857 4.816670822707551 1.8443777320443593 4.398137817234425 0.99 10.599097658485872 0.0 1406946.573 0.0 0.0 0.0 0.0 0.0 1444129.509 0.0 0.0 0.0 0.0 0.0 473791.565 0.0 0.0 0.0 0.0 0.0 504206.857 0.0 0.0 0.0 0.0 4.813 4.816 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -926 277 -925 -924 -923 -922 -921 261 -920 -919 -918 -917 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 452.276908 452.2766 4.816670822707551 4.813 4.816670822707551 4.816670822707551 4.816670822707551 4.816670822707551 4.816670822707551 4.816 4.816670822707551 4.816670822707551 4.816670822707551 4.816670822707551 802684.0 193880.515625 1 1 1 1 1 1 1 1 1 1 1 1 452.27716847000005 2.604700000574667E-4 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 5.684700000756493E-4 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 1000000.0 0.5759079127045165 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2569062506487245 1000000.0 1000000.0 1000000.0 1000000.0 0.0 39.9538188447716 0.0 0.0 0.0 0.0 0.0 20.86267438136151 0.0 0.0 0.0 0.0 C C 0.0 65.3908655397244 0.0 0.0 0.0 0.0 0.0 51.64028312218198 0.0 0.0 0.0 0.0 0.99 0.99 137.6831435257156 10.599097658485872 9.7518 10.339 0 11 0 0 0 0 0 11 0 0 0 0 -0 PE(18:1e)+H PE(18:1e)+H PE (18:1e) (18:1e) 480.30846847000004 C23 H47 O7 N1 P1 2506089.827 451569.499 4.656541868967601 0.8994913697827891 3.8085637609328113 0.85 10.204421256066517 0.0 2506089.827 0.0 0.0 0.0 0.0 0.0 2474412.02 0.0 0.0 0.0 0.0 0.0 451569.499 0.0 0.0 0.0 0.0 0.0 427885.244 0.0 0.0 0.0 0.0 4.648 4.653 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -936 255 -935 -934 -933 -932 -931 254 -930 -929 -928 -927 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 480.308325 480.308105 4.656541868967601 4.648 4.656541868967601 4.656541868967601 4.656541868967601 4.656541868967601 4.656541868967601 4.653 4.656541868967601 4.656541868967601 4.656541868967601 4.656541868967601 418636.09375 342411.4375 1 1 1 1 1 1 1 1 1 1 1 1 480.30846847000004 1.4347000001180277E-4 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 3.6347000002479035E-4 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 1000000.0 0.29870387351032907 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7567428514900162 1000000.0 1000000.0 1000000.0 1000000.0 0.0 33.401132410200255 0.0 0.0 0.0 0.0 0.0 34.588087577729446 0.0 0.0 0.0 0.0 C C 0.0 65.36425129197703 0.0 0.0 0.0 0.0 0.0 67.8197795641754 0.0 0.0 0.0 0.0 0.85 0.82 10.204421256066517 282.91333796457104 6.2742 7.9057 0 26 0 0 0 0 0 27 0 0 0 0 -1 PE(18:1e)+H PE(18:1e)+H PE (18:1e) (18:1e) 480.30846847000004 C23 H47 O7 N1 P1 6838611.795 3055402.371 4.897 4.3943079223391335 11.904022823011372 1.0 2627.267422008382 0.0 6838611.795 0.0 0.0 0.0 0.0 0.0 6426434.322 0.0 0.0 0.0 0.0 0.0 3055402.371 0.0 0.0 0.0 0.0 0.0 2580965.852 0.0 0.0 0.0 0.0 4.894 4.898 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -947 -946 -945 -944 -943 -942 -941 275 -940 -939 -938 -937 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 480.30847 480.30755 4.897 4.894 4.897 4.897 4.897 4.897 4.897 4.898 4.897 4.897 4.897 4.897 309893.25 1 1 1 1 1 1 1 1 1 1 1 1 480.30846847000004 1.5299999631679384E-6 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 9.184700000446355E-4 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 1000000.0 0.003185452815441046 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.9122502731846023 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.66945706419342 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 61.61536984882316 0.0 0.0 0.0 0.0 1.0 1.0 2627.267422008382 250.0086024532555 16.9053 14.6241 0 8 0 0 0 0 0 8 0 0 0 0 -0 PE(18:2e)+H PE(18:2e)+H PE (18:2e) (18:2e) 478.2928184700001 C23 H45 O7 N1 P1 2493455.726 721926.535 4.686443046632813 29.265701182958146 20.69535471201411 0.92 84.01923166885211 0.0 2493455.726 0.0 0.0 0.0 0.0 0.0 1638408.7026000046 0.0 0.0 0.0 0.0 0.0 721926.535 0.0 0.0 0.0 0.0 0.0 537608.3899999999 0.0 0.0 0.0 0.0 4.693 4.678 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.94 -957 257 -956 -955 -954 -953 -952 256 -951 -950 -949 -948 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 478.29245 478.292572 4.686443046632813 4.693 4.686443046632813 4.686443046632813 4.686443046632813 4.686443046632813 4.686443046632813 4.678 4.686443046632813 4.686443046632813 4.686443046632813 4.686443046632813 597735.1875 724438.4375 1 1 1 1 1 1 1 1 1 1 1 1 478.2928184700001 3.684700001258534E-4 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 2.464700000928133E-4 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 1000000.0 0.7703858094807771 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5153119398305843 1000000.0 1000000.0 1000000.0 1000000.0 0.0 27.324263523480212 0.0 0.0 0.0 0.0 0.0 22.625656186222532 0.0 0.0 0.0 0.0 C C 0.0 67.1357826129735 0.0 0.0 0.0 0.0 0.0 56.14306745960926 0.0 0.0 0.0 0.0 0.92 0.5681757880510784 84.01923166885211 724438.44 4.1498 2.0227 0 15 0 0 0 0 0 10 0 0 0 0 -0 PE(18:2e)+H PE(18:2e)+H PE (18:2e) (18:2e) 478.2928184700001 C23 H45 O7 N1 P1 1.1577669382E7 4426834.793 4.913 3.459430681353315 3.347412804442479 0.99 366.86799896861396 0.0 1.1577669382E7 0.0 0.0 0.0 0.0 0.0 1.1024771437E7 0.0 0.0 0.0 0.0 0.0 4426834.793 0.0 0.0 0.0 0.0 0.0 4222116.005 0.0 0.0 0.0 0.0 4.916 4.919 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.92 0.93 -968 274 -967 -966 -965 -964 -963 -962 -961 -960 -959 -958 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 478.292358 478.29282 4.913 4.916 4.913 4.913 4.913 4.913 4.913 4.919 4.913 4.913 4.913 4.913 1752245.875 1 1 1 1 1 1 1 1 1 1 1 1 478.2928184700001 4.604700001209494E-4 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 1.5299999063245195E-6 478.2928184700001 478.2928184700001 478.2928184700001 478.2928184700001 1000000.0 0.962736596367757 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0031988770210240685 1000000.0 1000000.0 1000000.0 1000000.0 0.0 32.87026168818297 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 64.07458418749118 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 366.86799896861396 498.1895791043649 16.6709 24.9827 0 10 0 0 0 0 0 9 0 0 0 0 -0 PE(18:3e)+Na PE(18:3e)+Na PE (18:3e) (18:3e) 498.25911347000005 C23 H42 O7 N1 P1 Na1 1302384.948 298079.68 4.813188409018356 19.459067881534615 4.1097766546579155 0.84 6.614166229631786 0.0 1302384.948 0.0 0.0 0.0 0.0 0.0 987328.629 0.0 0.0 0.0 0.0 0.0 281244.232 0.0 0.0 0.0 0.0 0.0 298079.68 0.0 0.0 0.0 0.0 4.793 4.803 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 1.0 0.73 -979 -978 -977 -976 -975 -974 -973 267 -972 -971 -970 -969 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 498.25911 498.258411 4.813188409018356 4.793 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 4.803 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 329554.15625 1 1 1 1 1 1 1 1 1 1 1 1 498.25911347000005 3.470000024208275E-6 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 7.024700000215489E-4 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 1000000.0 0.006964247979414434 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4098487735214187 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 48.58794711190888 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 68.91907391760125 0.0 0.0 0.0 0.0 0.84 0.89 6.614166229631786 329554.16 7.3039 8.2501 0 20 0 0 0 0 0 28 0 0 0 0 -0 PE(18:3e)+H PE(18:3e)+H PE (18:3e) (18:3e) 476.27716847000005 C23 H43 O7 N1 P1 1.5679464635E7 5615613.936 4.813188409018356 2.097046045442762 5.7988595075609055 0.99 90.55351018233168 0.0 1.522125776E7 0.0 0.0 0.0 0.0 0.0 1.5679464635E7 0.0 0.0 0.0 0.0 0.0 5173226.916 0.0 0.0 0.0 0.0 0.0 5615613.936 0.0 0.0 0.0 0.0 4.804 4.807 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -990 -989 -988 -987 -986 -985 -984 255 -983 -982 -981 -980 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 476.27717 476.277191 4.813188409018356 4.804 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 4.807 4.813188409018356 4.813188409018356 4.813188409018356 4.813188409018356 647419.0 1 1 1 1 1 1 1 1 1 1 1 1 476.27716847000005 1.5299999631679384E-6 476.27716847000005 476.27716847000005 476.27716847000005 476.27716847000005 476.27716847000005 2.2529999966991454E-5 476.27716847000005 476.27716847000005 476.27716847000005 476.27716847000005 1000000.0 0.0032124150903200615 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.04730438798770717 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 38.07188154420857 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 74.50466055618118 0.0 0.0 0.0 0.0 0.98 0.99 2.270858687407669 90.55351018233168 11.9971 11.1491 0 11 0 0 0 0 0 11 0 0 0 0 -0 PE(22:2)+H PE(22:2)+H PE (22:2) (22:2) 548.3346834700002 C27 H51 O8 N1 P1 1063570.555 452341.771 4.872487977324715 4.229564573954909 1.5808438684222488 0.99 11.471858868548455 1063570.555 0.0 0.0 0.0 0.0 0.0 1001800.395 0.0 0.0 0.0 0.0 0.0 452341.771 0.0 0.0 0.0 0.0 0.0 442340.782 0.0 0.0 0.0 0.0 0.0 4.87 4.872 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 285 -1000 -999 -998 -997 -996 295 -995 -994 -993 -992 -991 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 548.334516 548.334283 4.87 4.872487977324715 4.872487977324715 4.872487977324715 4.872487977324715 4.872487977324715 4.872 4.872487977324715 4.872487977324715 4.872487977324715 4.872487977324715 4.872487977324715 440612.40625 401782.71875 1 1 1 1 1 1 1 1 1 1 1 1 1.6747000017858227E-4 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 4.00470000158748E-4 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 0.3054156616882045 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7303386275412542 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 21.713565230424692 0.0 0.0 0.0 0.0 0.0 22.48214493699012 0.0 0.0 0.0 0.0 0.0 C C 42.91218424985118 0.0 0.0 0.0 0.0 0.0 44.34348113804758 0.0 0.0 0.0 0.0 0.0 0.99 0.99 11.471858868548455 2.773352954483448 9.8325 24.9561 9 0 0 0 0 0 8 0 0 0 0 0 -0 PE(30:0)+Na PE(30:0)+Na PE (30:0) (30:0) 686.4731284700001 C35 H70 O8 N1 P1 Na1 3747517.984 735560.814 3.718 0.5822342648120226 5.999340504390149 0.97 10.054262109536888 3747517.984 0.0 0.0 0.0 0.0 0.0 3716787.305 0.0 0.0 0.0 0.0 0.0 675692.968 0.0 0.0 0.0 0.0 0.0 735560.814 0.0 0.0 0.0 0.0 0.0 3.714 3.714 0.05 0.0 0.0 0.0 0.0 0.0 0.045 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.8 0.74 165 -1011 -1010 -1009 -1008 -1007 -1006 -1005 -1004 -1003 -1002 -1001 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 686.47583 686.47313 3.714 3.718 3.718 3.718 3.718 3.718 3.714 3.718 3.718 3.718 3.718 3.718 376831.34375 1 1 1 1 1 1 1 1 1 1 1 1 0.0027015299998538467 686.4731284700001 686.4731284700001 686.4731284700001 686.4731284700001 686.4731284700001 1.5299998494811007E-6 686.4731284700001 686.4731284700001 686.4731284700001 686.4731284700001 686.4731284700001 3.9353761827137674 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0022287833070627817 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.210026515476073 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 51.58442094530766 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.96 10.054262109536888 11.133783306094879 19.8102 23.1033 27 0 0 0 0 0 26 0 0 0 0 0 -1 PE(32:0)+Na PE(32:0)+Na PE (32:0) (32:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 1.0354943489E7 610119.871 1.915 125.81169202650244 80.83806653775581 0.83 0.052467823806690746 1.0354943489E7 0.0 0.0 0.0 0.0 0.0 604854.7956000001 0.0 0.0 0.0 0.0 0.0 610119.871 0.0 0.0 0.0 0.0 0.0 166305.97000000003 0.0 0.0 0.0 0.0 0.0 1.914 1.904 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 83 -1022 -1021 -1020 -1019 -1018 -1017 -1016 -1015 -1014 -1013 -1012 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.507701 714.50443 1.914 1.915 1.915 1.915 1.915 1.915 1.904 1.915 1.915 1.915 1.915 1.915 223565.828125 1 1 1 1 1 1 1 1 1 1 1 1 0.003272529999890139 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 4.580139561762762 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021413441100111264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 35.013007163114054 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 68.78783332635375 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 0.4061175958754991 0.052467823806690746 0.0 3.7721 1.4969 62 0 0 0 0 0 11 0 0 0 0 0 -1 PE(32:0)+Na PE(32:0)+Na PE (32:0) (32:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 3.1192969963E7 892673.988 2.442 61.11360879140935 3.326020813116701 0.68 2.8259615669703746 3.1192969963E7 0.0 0.0 0.0 0.0 0.0 1.2368418231E7 0.0 0.0 0.0 0.0 0.0 851650.07 0.0 0.0 0.0 0.0 0.0 892673.988 0.0 0.0 0.0 0.0 0.0 2.485 2.447 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 117 -1033 -1032 -1031 -1030 -1029 -1028 -1027 -1026 -1025 -1024 -1023 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.507344 714.50443 2.485 2.442 2.442 2.442 2.442 2.442 2.447 2.442 2.442 2.442 2.442 2.442 853237.9375 1 1 1 1 1 1 1 1 1 1 1 1 0.002915529999881983 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 4.080492553594295 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021413441100111264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 35.88579917613585 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 70.2266128691504 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.68 0.75 2.8259615669703746 0.7222435684818459 2.1007 1.4693 137 0 0 0 0 0 47 0 0 0 0 0 -1 PE(32:0)+Na PE(32:0)+Na PE (32:0) (32:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 4993970.41 411310.088 3.035 139.31411375070303 118.16372216547015 0.48 -0.5238402123438373 37485.48989999996 0.0 0.0 0.0 0.0 0.0 4993970.41 0.0 0.0 0.0 0.0 0.0 36851.5 0.0 0.0 0.0 0.0 0.0 411310.088 0.0 0.0 0.0 0.0 0.0 3.041 2.968 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 130 -1044 -1043 -1042 -1041 -1040 -1039 -1038 -1037 -1036 -1035 -1034 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.506841 714.50443 3.041 3.035 3.035 3.035 3.035 3.035 2.968 3.035 3.035 3.035 3.035 3.035 323168.375 1 1 1 1 1 1 1 1 1 1 1 1 0.0024125299999013805 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 3.3765081135570254 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021413441100111264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 29.23069572059842 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 71.46869369339468 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.48 0.0 -0.5238402123438373 1.6055 1.0698 5 0 0 0 0 0 9 0 0 0 0 0 -0 PE(16:0_16:0)+Na PE(32:0)+Na PE (16:0_16:0) (16:0) (16:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 3.1752890885E7 4915343.677 3.681 5.195640849142884 1.631779932309807 0.98 11.045039553307399 2.9502447618E7 0.0 0.0 0.0 0.0 0.0 3.1752890885E7 0.0 0.0 0.0 0.0 0.0 4915343.677 0.0 0.0 0.0 0.0 0.0 4803206.895 0.0 0.0 0.0 0.0 0.0 3.684 3.676 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 169 -1055 -1054 -1053 -1052 -1051 -1050 -1049 -1048 -1047 -1046 -1045 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.506272 714.50443 3.684 3.681 3.681 3.681 3.681 3.681 3.676 3.681 3.681 3.681 3.681 3.681 4246605.0 1 1 1 1 1 1 1 1 1 1 1 1 0.0018435299998600385 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 2.5801519576410055 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021413441100111264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 45.40795989997895 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 73.9543320846563 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.98 9.482543236952578 11.045039553307399 17.6775 21.7316 26 0 0 0 0 0 26 0 0 0 0 0 -0 PE(32:2)+H PE(32:2)+H PE (32:2) (32:2) 688.4911834700001 C37 H71 O8 N1 P1 5248406.173 1019731.157 3.6935532430167335 4.130547456125052 16.171141043571033 0.94 15.3718074302616 4950522.185 0.0 0.0 0.0 0.0 0.0 5248406.173 0.0 0.0 0.0 0.0 0.0 810454.489 0.0 0.0 0.0 0.0 0.0 1019731.157 0.0 0.0 0.0 0.0 0.0 3.718 3.713 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 161 -1066 -1065 -1064 -1063 -1062 -1061 -1060 -1059 -1058 -1057 -1056 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 688.491363 688.49118 3.718 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.713 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 421399.09375 1 1 1 1 1 1 1 1 1 1 1 1 1.7952999985482165E-4 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 3.470000137895113E-6 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 0.2607586039809388 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005040006642360022 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 35.26786430078678 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 68.74827349081247 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.94 15.926947391251094 15.3718074302616 16.3361 17.3758 26 0 0 0 0 0 23 0 0 0 0 0 -0 PE(32:2)+Na PE(32:2)+Na PE (32:2) (32:2) 710.4731284700001 C37 H70 O8 N1 P1 Na1 2974381.37 459998.94 3.6935532430167335 6.445185589815411 9.316262855729086 0.98 7.444975672461659 2715087.554 0.0 0.0 0.0 0.0 0.0 2974381.37 0.0 0.0 0.0 0.0 0.0 403138.933 0.0 0.0 0.0 0.0 0.0 459998.94 0.0 0.0 0.0 0.0 0.0 3.681 3.674 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 162 -1077 -1076 -1075 -1074 -1073 -1072 -1071 -1070 -1069 -1068 -1067 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 710.476318 710.47313 3.681 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.674 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 3.6935532430167335 432675.34375 1 1 1 1 1 1 1 1 1 1 1 1 0.0031895299998723203 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 1.5299998494811007E-6 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 4.489304200344573 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021534943239527537 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 18.73713491954763 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 61.63531223535404 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 10.75743571279716 7.444975672461659 16.1067 16.5949 28 0 0 0 0 0 27 0 0 0 0 0 -0 PE(32:3)+H PE(32:3)+H PE (32:3) (32:3) 686.4755334700002 C37 H69 O8 N1 P1 4860204.215 937961.93 3.709810306071408 3.8180787748605316 12.140356142645237 0.97 13.57835519026278 4604672.478 0.0 0.0 0.0 0.0 0.0 4860204.215 0.0 0.0 0.0 0.0 0.0 789654.234 0.0 0.0 0.0 0.0 0.0 937961.93 0.0 0.0 0.0 0.0 0.0 3.718 3.713 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1088 -1087 -1086 -1085 -1084 -1083 156 -1082 -1081 -1080 -1079 -1078 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 686.47553 686.475464 3.718 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.713 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 427411.15625 1 1 1 1 1 1 1 1 1 1 1 1 3.470000137895113E-6 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 6.947000019863481E-5 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 0.005054805260655012 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10119807161586296 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 14.536776039814589 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 71.25870607752249 0.0 0.0 0.0 0.0 0.0 0.94 0.97 34.719657776161704 13.57835519026278 19.9396 16.7747 26 0 0 0 0 0 23 0 0 0 0 0 -0 PE(32:3)+Na PE(32:3)+Na PE (32:3) (32:3) 708.4574784700002 C37 H68 O8 N1 P1 Na1 3443797.346 626674.106 3.709810306071408 9.28358197450392 18.338822008522335 0.82 27.381494331154375 3019514.302 0.0 0.0 0.0 0.0 0.0 3443797.346 0.0 0.0 0.0 0.0 0.0 482802.648 0.0 0.0 0.0 0.0 0.0 626674.106 0.0 0.0 0.0 0.0 0.0 3.692 3.712 0.05 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.048 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 1.0 -1099 -1098 -1097 -1096 -1095 -1094 157 -1093 -1092 -1091 -1090 -1089 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 708.45748 708.460669 3.692 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.712 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 3.709810306071408 466954.875 1 1 1 1 1 1 1 1 1 1 1 1 1.5299998494811007E-6 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 0.0031905299998697956 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 0.002159621284237582 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.5034883487434305 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.391110363864438 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 62.04961518314989 0.0 0.0 0.0 0.0 0.0 0.97 0.82 26.579037924349215 27.381494331154375 17.2942 20.5115 27 0 0 0 0 0 24 0 0 0 0 0 -0 PE(33:1)+Na PE(33:1)+Na PE (33:1) (33:1) 726.5044284700001 C38 H74 O8 N1 P1 Na1 1996233.766 311889.004 3.654 87.25494126155601 38.90083538044101 0.94 7.3273332246767 1996233.766 0.0 0.0 0.0 0.0 0.0 472846.6733999996 0.0 0.0 0.0 0.0 0.0 311889.004 0.0 0.0 0.0 0.0 0.0 177321.62 0.0 0.0 0.0 0.0 0.0 3.655 3.661 0.05 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.05 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.86 0.66 156 -1110 -1109 -1108 -1107 -1106 -1105 -1104 -1103 -1102 -1101 -1100 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 726.507568 726.50443 3.655 3.654 3.654 3.654 3.654 3.654 3.661 3.654 3.654 3.654 3.654 3.654 248326.625 1 1 1 1 1 1 1 1 1 1 1 1 0.0031395299998848714 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 1.5299998494811007E-6 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 4.3214189437174415 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021059745674272645 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.823008295020801 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 57.65354747545347 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.8351257965370348 7.3273332246767 95.17174325813605 9.5141 1.5617 29 0 0 0 0 0 8 0 0 0 0 0 -0 PE(34:2)+Na PE(34:2)+Na PE (34:2) (34:2) 738.5044284700001 C39 H74 O8 N1 P1 Na1 4.3818400464E7 7163552.134 3.654 2.438020513159566 2.1652905586965665 0.98 24.278987721232618 4.2333197878E7 0.0 0.0 0.0 0.0 0.0 4.3818400464E7 0.0 0.0 0.0 0.0 0.0 6947499.01 0.0 0.0 0.0 0.0 0.0 7163552.134 0.0 0.0 0.0 0.0 0.0 3.644 3.633 0.062 0.0 0.0 0.0 0.0 0.0 0.049 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.75 0.77 157 -1121 -1120 -1119 -1118 -1117 -1116 -1115 -1114 -1113 -1112 -1111 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.5054 738.50443 3.644 3.654 3.654 3.654 3.654 3.654 3.633 3.654 3.654 3.654 3.654 3.654 6929111.5 1 1 1 1 1 1 1 1 1 1 1 1 9.71529999901577E-4 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 1.5299998494811007E-6 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 1.3155371348474492 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002071754468217455 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.741129039687568 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 63.88714899575266 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 0.98 10.387274479907893 24.278987721232618 20.2859 24.1637 28 0 0 0 0 0 29 0 0 0 0 0 -1 PE(16:0_18:3)+Na PE(34:3)+Na PE (16:0_18:3) (16:0) (18:3) 736.48877847 C39 H72 O8 N1 P1 Na1 2.0934794092E7 1207404.143 1.9336767718987111 135.04775456581507 94.97852658360937 0.49 0.1491939740060852 482621.86770000175 0.0 0.0 0.0 0.0 0.0 2.0934794092E7 0.0 0.0 0.0 0.0 0.0 237205.1299999999 0.0 0.0 0.0 0.0 0.0 1207404.143 0.0 0.0 0.0 0.0 0.0 1.932 1.901 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.69 1.0 -1132 -1131 -1130 -1129 -1128 -1127 87 -1126 -1125 -1124 -1123 -1122 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.48878 736.491484 1.932 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.901 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1024758.625 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 736.48877847 736.48877847 736.48877847 736.48877847 736.48877847 0.0027055299999574345 736.48877847 736.48877847 736.48877847 736.48877847 736.48877847 0.0020774246775984804 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.6735522373850276 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 33.02946265351897 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 65.01862727070665 0.0 0.0 0.0 0.0 0.0 0.0 0.49 0.0 0.1491939740060852 1.1229 4.2693 7 0 0 0 0 0 70 0 0 0 0 0 -1 PE(34:3)+H PE(34:3)+H PE (16:0_18:3) (16:0) (18:3) 714.5068334700001 C39 H73 O8 N1 P1 1.0354943489E7 610119.871 1.9336767718987111 140.3537668141206 122.33851245947385 0.83 0.052467823806690746 1.0354943489E7 0.0 0.0 0.0 0.0 0.0 39232.80389999985 0.0 0.0 0.0 0.0 0.0 610119.871 0.0 0.0 0.0 0.0 0.0 44141.75 0.0 0.0 0.0 0.0 0.0 1.914 1.932 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1143 -1142 -1141 -1140 -1139 -1138 82 -1137 -1136 -1135 -1134 -1133 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.50443 714.508674 1.914 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.932 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 1.9336767718987111 432233.5625 1 1 1 1 1 1 1 1 1 1 1 1 0.00240347000010388 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 0.0018405299999812996 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 3.363816673986778 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.5759445729060024 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 36.23433371781139 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 71.04771317217921 0.0 0.0 0.0 0.0 0.0 0.83 0.9561120013139768 0.052467823806690746 0.0 3.7721 1.4969 62 0 0 0 0 0 5 0 0 0 0 0 -1 PE(34:3)+H PE(34:3)+H PE (34:3) (34:3) 714.5068334700001 C39 H73 O8 N1 P1 3.2065237918E7 894818.954 2.4520779486131987 62.44122982537108 1.8880975340403 0.46 0.7502316210386006 3.2065237918E7 0.0 0.0 0.0 0.0 0.0 1.2422664664E7 0.0 0.0 0.0 0.0 0.0 871240.531 0.0 0.0 0.0 0.0 0.0 894818.954 0.0 0.0 0.0 0.0 0.0 2.443 2.449 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 108 -1153 -1152 -1151 -1150 -1149 103 -1148 -1147 -1146 -1145 -1144 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.509041 714.507902 2.443 2.4520779486131987 2.4520779486131987 2.4520779486131987 2.4520779486131987 2.4520779486131987 2.449 2.4520779486131987 2.4520779486131987 2.4520779486131987 2.4520779486131987 2.4520779486131987 559633.375 765974.0625 1 1 1 1 1 1 1 1 1 1 1 1 0.0022075299999642084 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 0.0010685299998840492 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 3.0895855666535 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4954790490872378 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 26.534456219048582 0.0 0.0 0.0 0.0 0.0 34.72106072422586 0.0 0.0 0.0 0.0 0.0 C C 64.87642107346844 0.0 0.0 0.0 0.0 0.0 67.81457172700365 0.0 0.0 0.0 0.0 0.0 0.46 0.62 0.7502316210386006 89.75554708655913 2.228 1.5077 110 0 0 0 0 0 82 0 0 0 0 0 -0 PE(16:0_18:3)+H PE(34:3)+H PE (16:0_18:3) (16:0) (18:3) 714.5068334700001 C39 H73 O8 N1 P1 3.2060763347E7 4926527.851 3.6628562225854466 4.640737692957137 1.8332157331098962 0.98 8.018597167479433 3.0023471002E7 0.0 0.0 0.0 0.0 0.0 3.2060763347E7 0.0 0.0 0.0 0.0 0.0 4926527.851 0.0 0.0 0.0 0.0 0.0 4800439.193 0.0 0.0 0.0 0.0 0.0 3.684 3.676 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 143 -1163 -1162 -1161 -1160 -1159 160 -1158 -1157 -1156 -1155 -1154 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.508664 714.505893 3.684 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.676 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 314367.28125 4547751.0 1 1 1 1 1 1 1 1 1 1 1 1 0.0018305299998928604 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 9.404700000459343E-4 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 2.5619489053770104 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.316250532522614 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 39.74112747659682 0.0 0.0 0.0 0.0 0.0 29.127007572999638 0.0 0.0 0.0 0.0 0.0 B C 65.14938930589645 0.0 0.0 0.0 0.0 0.0 71.21517744009692 0.0 0.0 0.0 0.0 0.0 0.96 0.98 7.7275201629429535 8.018597167479433 17.4564 21.033 26 0 0 0 0 0 26 0 0 0 0 0 -0 PE(16:0_18:3)+Na PE(34:3)+Na PE (16:0_18:3) (16:0) (18:3) 736.48877847 C39 H72 O8 N1 P1 Na1 4.7438974225E7 7703342.281 3.6628562225854466 14.434254934188845 3.3851108260712666 0.95 9.208015155136117 3.8652043262E7 0.0 0.0 0.0 0.0 0.0 4.7438974225E7 0.0 0.0 0.0 0.0 0.0 7343183.403 0.0 0.0 0.0 0.0 0.0 7703342.281 0.0 0.0 0.0 0.0 0.0 3.657 3.666 0.045 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.74 1.0 131 -1174 -1173 -1172 -1171 -1170 -1169 -1168 -1167 -1166 -1165 -1164 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.491397 736.48878 3.657 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.666 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 3.6628562225854466 398713.34375 1 1 1 1 1 1 1 1 1 1 1 1 0.0026185299999497147 736.48877847 736.48877847 736.48877847 736.48877847 736.48877847 1.5299999631679384E-6 736.48877847 736.48877847 736.48877847 736.48877847 736.48877847 3.5554241646281612 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020774246775984804 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 33.489093353317244 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 65.79389656840324 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.95 5.506942695667935 9.208015155136117 19.1695 25.3066 27 0 0 0 0 0 26 0 0 0 0 0 -0 PE(16:0p_18:3)+H PE(34:3p)+H PE (16:0p_18:3) (16:0p) (18:3) 698.5119184700001 C39 H73 O7 N1 P1 3352320.028 470433.743 3.5254976831250042 13.000595122361897 4.711753173228525 0.96 8.72982776627069 2787864.586 0.0 0.0 0.0 0.0 0.0 3352320.028 0.0 0.0 0.0 0.0 0.0 440097.46 0.0 0.0 0.0 0.0 0.0 470433.743 0.0 0.0 0.0 0.0 0.0 3.53 3.524 0.056 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.63 1.0 138 -1184 -1183 -1182 -1181 -1180 130 -1179 -1178 -1177 -1176 -1175 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 698.513284 698.51206 3.53 3.5254976831250042 3.5254976831250042 3.5254976831250042 3.5254976831250042 3.5254976831250042 3.524 3.5254976831250042 3.5254976831250042 3.5254976831250042 3.5254976831250042 3.5254976831250042 303077.09375 223052.859375 1 1 1 1 1 1 1 1 1 1 1 1 0.0013655299999300041 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 1.4152999995076243E-4 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 1.954912956848354 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.20261644248070323 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 11.722424856651001 0.0 0.0 0.0 0.0 0.0 9.174400048978386 0.0 0.0 0.0 0.0 0.0 B B 58.612124283255 0.0 0.0 0.0 0.0 0.0 45.64378133820093 0.0 0.0 0.0 0.0 0.0 0.95 0.96 6.095849098998022 8.72982776627069 17.9484 17.8098 29 0 0 0 0 0 29 0 0 0 0 0 -0 PE(34:4)+H PE(34:4)+H PE (34:4) (34:4) 712.4911834700001 C39 H71 O8 N1 P1 6592220.874 1003164.313 3.6613883783887973 3.5071881971543246 2.5878834761292624 0.96 21.542888070475616 6273164.896 0.0 0.0 0.0 0.0 0.0 6592220.874 0.0 0.0 0.0 0.0 0.0 1003164.313 0.0 0.0 0.0 0.0 0.0 967110.066 0.0 0.0 0.0 0.0 0.0 3.655 3.67 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 151 -1194 -1193 -1192 -1191 -1190 140 -1189 -1188 -1187 -1186 -1185 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 712.491943 712.491882 3.655 3.6613883783887973 3.6613883783887973 3.6613883783887973 3.6613883783887973 3.6613883783887973 3.67 3.6613883783887973 3.6613883783887973 3.6613883783887973 3.6613883783887973 3.6613883783887973 410333.3125 349552.90625 1 1 1 1 1 1 1 1 1 1 1 1 7.595299998683913E-4 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 6.985299999087147E-4 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 1.0660202083754933 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9804051139365806 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 28.995186448905223 0.0 0.0 0.0 0.0 0.0 5.8810105428324455 0.0 0.0 0.0 0.0 0.0 C C 70.54789890244582 0.0 0.0 0.0 0.0 0.0 57.65696610620046 0.0 0.0 0.0 0.0 0.0 0.99 0.96 8.693116235133123 21.542888070475616 13.8651 13.6563 28 0 0 0 0 0 27 0 0 0 0 0 -0 PE(34:5)+H PE(34:5)+H PE (34:5) (34:5) 710.4755334700001 C39 H69 O8 N1 P1 2974381.37 459998.94 3.673 6.445185589815411 9.316262855729086 0.98 7.444975672461659 2715087.554 0.0 0.0 0.0 0.0 0.0 2974381.37 0.0 0.0 0.0 0.0 0.0 403138.933 0.0 0.0 0.0 0.0 0.0 459998.94 0.0 0.0 0.0 0.0 0.0 3.681 3.674 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1205 -1204 -1203 -1202 -1201 -1200 150 -1199 -1198 -1197 -1196 -1195 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 710.47313 710.476074 3.681 3.673 3.673 3.673 3.673 3.673 3.674 3.673 3.673 3.673 3.673 3.673 312016.375 1 1 1 1 1 1 1 1 1 1 1 1 0.00240347000010388 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 5.405299999665658E-4 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 3.382903262502518 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7608003013511088 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 5.49210561213714 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 53.32141371006931 0.0 0.0 0.0 0.0 0.0 0.99 0.98 10.75743571279716 7.444975672461659 16.1067 16.5949 28 0 0 0 0 0 27 0 0 0 0 0 -0 PE(34:6)+H PE(34:6)+H PE (34:6) (34:6) 708.4598834700001 C39 H67 O8 N1 P1 3600926.644 630073.687 3.681 3.624989380347717 6.596818430213322 0.86 8.874251421713275 3420938.368 0.0 0.0 0.0 0.0 0.0 3600926.644 0.0 0.0 0.0 0.0 0.0 573911.912 0.0 0.0 0.0 0.0 0.0 630073.687 0.0 0.0 0.0 0.0 0.0 3.684 3.712 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 163 -1216 -1215 -1214 -1213 -1212 -1211 -1210 -1209 -1208 -1207 -1206 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 708.460754 708.45988 3.684 3.681 3.681 3.681 3.681 3.681 3.712 3.681 3.681 3.681 3.681 3.681 359702.34375 1 1 1 1 1 1 1 1 1 1 1 1 8.705299998155169E-4 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 3.470000137895113E-6 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 1.2287639993837134 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0048979486613966484 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 11.875187053898157 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 58.49845839358697 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.86 10.244952383276956 8.874251421713275 18.4208 20.3937 25 0 0 0 0 0 25 0 0 0 0 0 -0 PE(35:4)+H PE(35:4)+H PE (35:4) (35:4) 726.5068334700001 C40 H73 O8 N1 P1 3074286.654 316967.973 3.664 26.314112566769115 1.896607464601659 0.86 6.225740754156363 2109706.823 0.0 0.0 0.0 0.0 0.0 3074286.654 0.0 0.0 0.0 0.0 0.0 316967.973 0.0 0.0 0.0 0.0 0.0 308578.741 0.0 0.0 0.0 0.0 0.0 3.654 3.661 0.054 0.0 0.0 0.0 0.0 0.0 0.079 0.0 0.0 0.0 0.0 0.0 0.05 0.0 0.0 0.0 0.0 0.0 0.077 0.0 0.0 0.0 0.0 0.0 0.85 0.66 -1227 -1226 -1225 -1224 -1223 -1222 145 -1221 -1220 -1219 -1218 -1217 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 726.50683 726.507324 3.654 3.664 3.664 3.664 3.664 3.664 3.661 3.664 3.664 3.664 3.664 3.664 260391.75 1 1 1 1 1 1 1 1 1 1 1 1 3.470000024208275E-6 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 4.905299999791168E-4 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 0.004776279952708198 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.675189795030844 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 28.85464590662155 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 70.54925649540722 0.0 0.0 0.0 0.0 0.0 0.94 0.86 7.303736251182426 6.225740754156363 10.3502 10.2531 30 0 0 0 0 0 30 0 0 0 0 0 -1 PE(36:3)+Na PE(36:3)+Na PE (36:3) (36:3) 764.52007847 C41 H76 O8 N1 P1 Na1 3974679.952 493291.97 3.621 3.9117920059849722 5.60083276326394 0.92 2.9996168271803474 3760714.708 0.0 0.0 0.0 0.0 0.0 3974679.952 0.0 0.0 0.0 0.0 0.0 455707.904 0.0 0.0 0.0 0.0 0.0 493291.97 0.0 0.0 0.0 0.0 0.0 3.619 3.63 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 145 -1238 -1237 -1236 -1235 -1234 -1233 -1232 -1231 -1230 -1229 -1228 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 764.520264 764.52008 3.619 3.621 3.621 3.621 3.621 3.621 3.63 3.621 3.621 3.621 3.621 3.621 243006.921875 1 1 1 1 1 1 1 1 1 1 1 1 1.8552999995335995E-4 764.52007847 764.52007847 764.52007847 764.52007847 764.52007847 1.5299999631679384E-6 764.52007847 764.52007847 764.52007847 764.52007847 764.52007847 0.24267511760404367 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002001255436259907 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 33.474577612488 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 66.02480791417752 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.92 2.0456556637003387 2.9996168271803474 10.7251 11.2778 40 0 0 0 0 0 40 0 0 0 0 0 -1 PE(36:4)+Na PE(36:4)+Na PE (36:4) (36:4) 762.5044284700001 C41 H74 O8 N1 P1 Na1 28350.10859999982 51669.25 1.913 134.07609750098482 126.88424691182112 0.0 0.0 28350.10859999982 0.0 0.0 0.0 0.0 0.0 755.8650000000216 0.0 0.0 0.0 0.0 0.0 51669.25 0.0 0.0 0.0 0.0 0.0 2799.5 0.0 0.0 0.0 0.0 0.0 1.913 1.904 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 97 -1249 -1248 -1247 -1246 -1245 -1244 -1243 -1242 -1241 -1240 -1239 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.502822 762.50443 1.913 1.913 1.913 1.913 1.913 1.913 1.904 1.913 1.913 1.913 1.913 1.913 202458.84375 1 1 1 1 1 1 1 1 1 1 1 1 0.0016064700000697485 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 1.5299998494811007E-6 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 2.1068336656000857 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020065455259730297 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.3149520970869695 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 21.049840323623233 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.8931 6.2913 3 0 0 0 0 0 2 0 0 0 0 0 -1 PE(36:4)+H PE(36:4)+H PE (36:4) (36:4) 740.5224834700001 C41 H75 O8 N1 P1 103015.56749999989 134569.75 2.1230806094483405 40.91448341767985 50.246130101618824 0.0 0.0 103015.56749999989 0.0 0.0 0.0 0.0 0.0 56784.0780000003 0.0 0.0 0.0 0.0 0.0 134569.75 0.0 0.0 0.0 0.0 0.0 64014.12999999989 0.0 0.0 0.0 0.0 0.0 2.125 2.124 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 125 -1259 -1258 -1257 -1256 -1255 85 -1254 -1253 -1252 -1251 -1250 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.520943 740.521596 2.125 2.1230806094483405 2.1230806094483405 2.1230806094483405 2.1230806094483405 2.1230806094483405 2.124 2.1230806094483405 2.1230806094483405 2.1230806094483405 2.1230806094483405 2.1230806094483405 633647.1875 1241997.125 1 1 1 1 1 1 1 1 1 1 1 1 0.0015404700001226956 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 8.874700000660596E-4 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 2.08024743948926 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1984376165156807 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 28.097851567321445 0.0 0.0 0.0 0.0 0.0 28.258767630774404 0.0 0.0 0.0 0.0 0.0 C C 68.53134528614989 0.0 0.0 0.0 0.0 0.0 68.75612562232217 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.7545 5.4449 3 0 0 0 0 0 3 0 0 0 0 0 -0 PE(36:4)+H PE(36:4)+H PE (36:4) (36:4) 740.5224834700001 C41 H75 O8 N1 P1 1.46144010731E8 8651736.89 3.6204473475800114 67.17871897253202 10.117543275786895 0.98 116.21293177097373 5.2013963879E7 0.0 0.0 0.0 0.0 0.0 1.46144010731E8 0.0 0.0 0.0 0.0 0.0 7496464.908 0.0 0.0 0.0 0.0 0.0 8651736.89 0.0 0.0 0.0 0.0 0.0 3.628 3.63 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 148 -1269 -1268 -1267 -1266 -1265 122 -1264 -1263 -1262 -1261 -1260 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.521072 740.521473 3.628 3.6204473475800114 3.6204473475800114 3.6204473475800114 3.6204473475800114 3.6204473475800114 3.63 3.6204473475800114 3.6204473475800114 3.6204473475800114 3.6204473475800114 3.6204473475800114 5093432.0 291066.3125 1 1 1 1 1 1 1 1 1 1 1 1 0.0014114700001073288 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 0.001010470000096575 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 1.9060461115148706 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.364536557163846 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 29.609371963313396 0.0 0.0 0.0 0.0 0.0 27.793883299432494 0.0 0.0 0.0 0.0 0.0 C C 72.04226755064089 0.0 0.0 0.0 0.0 0.0 67.78995926690855 0.0 0.0 0.0 0.0 0.0 0.96 0.98 5.142061299761791 116.21293177097373 28.0576 5.0504 28 0 0 0 0 0 176 0 0 0 0 0 -1 PE(36:5)+H PE(36:5)+H PE (36:5) (36:5) 738.5068334700001 C41 H73 O8 N1 P1 182835.15269999887 125473.06000000006 2.1314732498294933 80.52255304892157 43.21711393942498 0.0 0.0 182835.15269999887 0.0 0.0 0.0 0.0 0.0 50167.81950000033 0.0 0.0 0.0 0.0 0.0 125473.06000000006 0.0 0.0 0.0 0.0 0.0 66735.75 0.0 0.0 0.0 0.0 0.0 2.125 2.143 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 111 -1279 -1278 -1277 -1276 -1275 96 -1274 -1273 -1272 -1271 -1270 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.505896 738.506443 2.125 2.1314732498294933 2.1314732498294933 2.1314732498294933 2.1314732498294933 2.1314732498294933 2.143 2.1314732498294933 2.1314732498294933 2.1314732498294933 2.1314732498294933 2.1314732498294933 1254144.25 1074524.125 1 1 1 1 1 1 1 1 1 1 1 1 9.374700000535086E-4 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 3.9047000007030874E-4 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 1.2694127631137089 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5287290277811229 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 25.636159582270324 0.0 0.0 0.0 0.0 0.0 25.023677179895795 0.0 0.0 0.0 0.0 0.0 C C 62.68009677816706 0.0 0.0 0.0 0.0 0.0 61.18258479192127 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.7945 1.7703 5 0 0 0 0 0 4 0 0 0 0 0 -0 PE(36:5)+H PE(36:5)+H PE (36:5) (36:5) 738.5068334700001 C41 H73 O8 N1 P1 5.0006232132E7 8190943.853 3.6427987315248243 2.7539563827775395 2.3407442646252363 0.98 5.33171298905733 4.8095849839E7 0.0 0.0 0.0 0.0 0.0 5.0006232132E7 0.0 0.0 0.0 0.0 0.0 7924212.847 0.0 0.0 0.0 0.0 0.0 8190943.853 0.0 0.0 0.0 0.0 0.0 3.653 3.632 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 137 -1289 -1288 -1287 -1286 -1285 131 -1284 -1283 -1282 -1281 -1280 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.506897 738.50668 3.653 3.6427987315248243 3.6427987315248243 3.6427987315248243 3.6427987315248243 3.6427987315248243 3.632 3.6427987315248243 3.6427987315248243 3.6427987315248243 3.6427987315248243 3.6427987315248243 406112.8125 456504.53125 1 1 1 1 1 1 1 1 1 1 1 1 6.352999992031982E-5 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 1.5347000010024203E-4 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 0.08602493171500296 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2078112119547183 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 20.13754447460294 0.0 0.0 0.0 0.0 0.0 26.82841898283524 0.0 0.0 0.0 0.0 0.0 C C 65.17004684337523 0.0 0.0 0.0 0.0 0.0 65.43516825081768 0.0 0.0 0.0 0.0 0.0 0.91 0.98 4.793782712687672 5.33171298905733 27.1296 23.5245 26 0 0 0 0 0 27 0 0 0 0 0 -1 PE(18:3_18:3)+H PE(36:6)+H PE (18:3_18:3) (18:3) (18:3) 736.4911834700001 C41 H71 O8 N1 P1 185395.97249999948 147168.74999999988 1.934 15.052993753910643 3.642456415050007 0.8437488802805377 0.0 149725.40520000082 0.0 0.0 0.0 0.0 0.0 185395.97249999948 0.0 0.0 0.0 0.0 0.0 139778.1299999999 0.0 0.0 0.0 0.0 0.0 147168.74999999988 0.0 0.0 0.0 0.0 0.0 1.932 1.932 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.64 1.0 -1300 -1299 -1298 -1297 -1296 -1295 78 -1294 -1293 -1292 -1291 -1290 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.49118 736.491566 1.932 1.934 1.934 1.934 1.934 1.934 1.932 1.934 1.934 1.934 1.934 1.934 589165.9375 1 1 1 1 1 1 1 1 1 1 1 1 3.470000137895113E-6 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 3.825299999107301E-4 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 0.004711529772218187 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5193952195169923 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 30.853890066996332 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 61.09681201385412 0.0 0.0 0.0 0.0 0.0 0.0 0.8437488802805377 0.0 0.0 1.0754 1.3078 4 0 0 0 0 0 5 0 0 0 0 0 -1 PE(36:6)+H PE(36:6)+H PE (36:6) (36:6) 736.4911834700001 C41 H71 O8 N1 P1 124912.6722000011 80197.87000000011 2.161 76.70406936853122 47.863459030046485 0.0 0.0 124912.6722000011 0.0 0.0 0.0 0.0 0.0 37061.2880999998 0.0 0.0 0.0 0.0 0.0 80197.87000000011 0.0 0.0 0.0 0.0 0.0 39639.44000000006 0.0 0.0 0.0 0.0 0.0 2.163 2.172 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.75 118 -1311 -1310 -1309 -1308 -1307 -1306 -1305 -1304 -1303 -1302 -1301 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.49123 736.49118 2.163 2.161 2.161 2.161 2.161 2.161 2.172 2.161 2.161 2.161 2.161 2.161 1236515.625 1 1 1 1 1 1 1 1 1 1 1 1 4.652999984955386E-5 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 3.470000137895113E-6 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 0.06317794549871783 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004711529772218187 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 29.962513881324853 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 73.07930214957284 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.8472 1.0247 4 0 0 0 0 0 4 0 0 0 0 0 -1 PE(36:6)+H PE(36:6)+H PE (36:6) (36:6) 736.4911834700001 C41 H71 O8 N1 P1 5.0408081298E7 1410228.569 2.435 139.7897413430958 106.16352235578867 0.57 0.4875400540283459 5.0408081298E7 0.0 0.0 0.0 0.0 0.0 292472.7258000008 0.0 0.0 0.0 0.0 0.0 1410228.569 0.0 0.0 0.0 0.0 0.0 200826.5 0.0 0.0 0.0 0.0 0.0 2.441 2.449 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.61 -1322 -1321 -1320 -1319 -1318 -1317 114 -1316 -1315 -1314 -1313 -1312 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.49118 736.491386 2.441 2.435 2.435 2.435 2.435 2.435 2.449 2.435 2.435 2.435 2.435 2.435 593681.0 1 1 1 1 1 1 1 1 1 1 1 1 3.470000137895113E-6 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 2.0252999991043907E-4 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 0.004711529772218187 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.27499310847987746 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 20.758616516306333 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 67.17998872591048 0.0 0.0 0.0 0.0 0.0 0.57 0.0 0.4875400540283459 0.0 2.8632 1.116 133 0 0 0 0 0 7 0 0 0 0 0 -0 PE(18:3_18:3)+H PE(36:6)+H PE (18:3_18:3) (18:3) (18:3) 736.4911834700001 C41 H71 O8 N1 P1 4.8233776845E7 8738435.791 3.6562449891245508 0.8344203332848495 13.806187113316609 0.97 8.18904757205367 4.8233776845E7 0.0 0.0 0.0 0.0 0.0 4.7667933473E7 0.0 0.0 0.0 0.0 0.0 8738435.791 0.0 0.0 0.0 0.0 0.0 7184014.752 0.0 0.0 0.0 0.0 0.0 3.654 3.663 0.0 0.0 0.0 0.0 0.0 0.0 0.061 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.043 0.0 0.0 0.0 0.0 0.0 1.0 0.75 164 -1332 -1331 -1330 -1329 -1328 155 -1327 -1326 -1325 -1324 -1323 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.490647 736.490326 3.654 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.663 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 7320772.5 7794138.0 1 1 1 1 1 1 1 1 1 1 1 1 5.364700001564415E-4 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 8.574700001418023E-4 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 0.7284133363672423 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1642637676961818 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 31.591070742161854 0.0 0.0 0.0 0.0 0.0 33.46787501950453 0.0 0.0 0.0 0.0 0.0 A A 61.94327596502326 0.0 0.0 0.0 0.0 0.0 65.88164373918217 0.0 0.0 0.0 0.0 0.0 0.97 0.94 8.18904757205367 5.35460996951955 25.5389 26.2294 26 0 0 0 0 0 27 0 0 0 0 0 -0 PE(36:6)+Na PE(36:6)+Na PE (18:3_18:3) (18:3) (18:3) 758.4731284700001 C41 H70 O8 N1 P1 Na1 5432273.403 323668.873 3.6562449891245508 0.32444328888860646 0.9035526122864673 0.96 17.915327114774275 5407405.44 0.0 0.0 0.0 0.0 0.0 5432273.403 0.0 0.0 0.0 0.0 0.0 319559.236 0.0 0.0 0.0 0.0 0.0 323668.873 0.0 0.0 0.0 0.0 0.0 3.658 3.67 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 166 -1343 -1342 -1341 -1340 -1339 -1338 -1337 -1336 -1335 -1334 -1333 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 758.471451 758.47313 3.658 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.67 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 3.6562449891245508 196455.125 1 1 1 1 1 1 1 1 1 1 1 1 0.0016774700001178644 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 1.5299998494811007E-6 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 2.211640646388718 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002017210355978507 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.134120812172638 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 35.317429763230884 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.96 14.385093959816775 17.915327114774275 3.3142 3.9981 143 0 0 0 0 0 140 0 0 0 0 0 -0 PS(16:0_16:0)+Na PS(32:0)+Na PS (16:0_16:0) (16:0) (16:0) 758.4942584700001 C38 H74 O10 N1 P1 Na1 5738601.024 2052067.936 5.000444650649442 9.897796514037081 5.199014591313958 1.0 283.0015338119196 5738601.024 0.0 0.0 0.0 0.0 0.0 4987876.424 0.0 0.0 0.0 0.0 0.0 2052067.936 0.0 0.0 0.0 0.0 0.0 1906539.302 0.0 0.0 0.0 0.0 0.0 4.998 5.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.89 0.89 321 -1353 -1352 -1351 -1350 -1349 328 -1348 -1347 -1346 -1345 -1344 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 758.49625 758.496047 4.998 5.000444650649442 5.000444650649442 5.000444650649442 5.000444650649442 5.000444650649442 5.0 5.000444650649442 5.000444650649442 5.000444650649442 5.000444650649442 5.000444650649442 1891926.25 1347087.875 1 1 1 1 1 1 1 1 1 1 1 1 0.001991529999941122 758.4942584700001 758.4942584700001 758.4942584700001 758.4942584700001 758.4942584700001 0.0017885299998852133 758.4942584700001 758.4942584700001 758.4942584700001 758.4942584700001 758.4942584700001 2.6256362229535464 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3580007098444677 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.813757268458493 0.0 0.0 0.0 0.0 0.0 17.66787711020829 0.0 0.0 0.0 0.0 0.0 C A 53.337222646408186 0.0 0.0 0.0 0.0 0.0 56.99315196841385 0.0 0.0 0.0 0.0 0.0 1.0 1.0 283.0015338119196 4.946561284738994 14.5777 13.9439 10 0 0 0 0 0 10 0 0 0 0 0 -0 PS(34:0)+Na PS(34:0)+Na PS (34:0) (34:0) 786.5255584700001 C40 H78 O10 N1 P1 Na1 7456283.855 2994453.52 4.975497393268703 4.08802971396094 0.9903003758908775 0.99 9.187403317897145 7456283.855 0.0 0.0 0.0 0.0 0.0 7037321.054 0.0 0.0 0.0 0.0 0.0 2994453.52 0.0 0.0 0.0 0.0 0.0 2952807.934 0.0 0.0 0.0 0.0 0.0 4.975 4.976 0.017 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.88 0.87 314 -1363 -1362 -1361 -1360 -1359 330 -1358 -1357 -1356 -1355 -1354 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 786.525194 786.526022 4.975 4.975497393268703 4.975497393268703 4.975497393268703 4.975497393268703 4.975497393268703 4.976 4.975497393268703 4.975497393268703 4.975497393268703 4.975497393268703 4.975497393268703 3647817.5 1086047.0 1 1 1 1 1 1 1 1 1 1 1 1 3.644700000222656E-4 786.5255584700001 786.5255584700001 786.5255584700001 786.5255584700001 786.5255584700001 4.6352999993359845E-4 786.5255584700001 786.5255584700001 786.5255584700001 786.5255584700001 786.5255584700001 0.46339244300116067 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5893387633013308 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.619913415649196 0.0 0.0 0.0 0.0 0.0 5.191680497164059 0.0 0.0 0.0 0.0 0.0 C C 60.18103105135633 0.0 0.0 0.0 0.0 0.0 49.920004780423646 0.0 0.0 0.0 0.0 0.0 0.99 0.99 9.187403317897145 511.96546613914154 13.8172 16.6971 10 0 0 0 0 0 9 0 0 0 0 0 -0 PS(34:2)+Na PS(34:2)+Na PS (34:2) (34:2) 782.4942584700001 C40 H74 O10 N1 P1 Na1 2711866.779 1185958.29 4.978 0.7496211922840681 8.515155537804786 0.99 418.94143323669203 2711866.779 0.0 0.0 0.0 0.0 0.0 2683269.201 0.0 0.0 0.0 0.0 0.0 1185958.29 0.0 0.0 0.0 0.0 0.0 1051253.018 0.0 0.0 0.0 0.0 0.0 4.978 4.979 0.016 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.86 0.89 -1374 -1373 -1372 -1371 -1370 -1369 325 -1368 -1367 -1366 -1365 -1364 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 782.49426 782.495242 4.978 4.978 4.978 4.978 4.978 4.978 4.979 4.978 4.978 4.978 4.978 4.978 1303374.5 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 782.4942584700001 782.4942584700001 782.4942584700001 782.4942584700001 782.4942584700001 9.835299998712799E-4 782.4942584700001 782.4942584700001 782.4942584700001 782.4942584700001 782.4942584700001 0.0019552858651762195 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2569165706012488 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 5.409396931505214 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 51.03204652363409 0.0 0.0 0.0 0.0 0.0 0.99 0.99 418.94143323669203 1303374.5 9.509 10.6657 9 0 0 0 0 0 9 0 0 0 0 0 -0 PS(34:3)+Na PS(34:3)+Na PS (34:3) (34:3) 780.47860847 C40 H72 O10 N1 P1 Na1 2684585.375 1100639.235 4.986 7.888398271086042 13.282555149742059 0.97 6.927557284278153 2684585.375 0.0 0.0 0.0 0.0 0.0 2400918.997 0.0 0.0 0.0 0.0 0.0 1100639.235 0.0 0.0 0.0 0.0 0.0 911642.057 0.0 0.0 0.0 0.0 0.0 4.988 4.988 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.81 0.86 -1385 -1384 -1383 -1382 -1381 -1380 327 -1379 -1378 -1377 -1376 -1375 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.47861 780.479793 4.988 4.986 4.986 4.986 4.986 4.986 4.988 4.986 4.986 4.986 4.986 4.986 1115688.75 1 1 1 1 1 1 1 1 1 1 1 1 1.5299999631679384E-6 780.47860847 780.47860847 780.47860847 780.47860847 780.47860847 0.0011845299999322378 780.47860847 780.47860847 780.47860847 780.47860847 780.47860847 0.0019603355512423995 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5176969452811961 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 5.2381953104437855 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 49.88757438517891 0.0 0.0 0.0 0.0 0.0 0.97 0.98 6.927557284278153 1115688.75 14.0497 7.7766 9 0 0 0 0 0 11 0 0 0 0 0 -0 SM(d30:1)+H SM(d30:1)+H SM (d30:1) (d30:1) 647.5122524700001 C35 H72 O6 N2 P1 1218099.352 543890.771 4.979 7.497987243169363 7.839845337724986 0.98 416.9839641018506 1218099.352 0.0 0.0 0.0 0.0 0.0 1095438.411 0.0 0.0 0.0 0.0 0.0 543890.771 0.0 0.0 0.0 0.0 0.0 486755.769 0.0 0.0 0.0 0.0 0.0 4.977 4.978 0.015 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.93 0.96 313 -1396 -1395 -1394 -1393 -1392 -1391 -1390 -1389 -1388 -1387 -1386 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 647.511995 647.51225 4.977 4.979 4.979 4.979 4.979 4.979 4.978 4.979 4.979 4.979 4.979 4.979 494916.5625 1 1 1 1 1 1 1 1 1 1 1 1 2.574700001787278E-4 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 2.47000014041987E-6 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 0.3976295416752081 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.003814599848879783 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.966114155095323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 43.220380516984406 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 416.9839641018506 612449.0 35.5112 35.8524 8 0 0 0 0 0 8 0 0 0 0 0 -0 SM(d31:1)+H SM(d31:1)+H SM (d31:1) (d31:1) 661.5279024700002 C36 H74 O6 N2 P1 1834959.646 816328.111 4.967542375268892 2.712702223808268 12.221877871518005 0.99 477.61065239365263 1765889.238 0.0 0.0 0.0 0.0 0.0 1834959.646 0.0 0.0 0.0 0.0 0.0 686454.999 0.0 0.0 0.0 0.0 0.0 816328.111 0.0 0.0 0.0 0.0 0.0 4.969 4.968 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 307 -1406 -1405 -1404 -1403 -1402 324 -1401 -1400 -1399 -1398 -1397 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 661.528312 661.526933 4.969 4.967542375268892 4.967542375268892 4.967542375268892 4.967542375268892 4.967542375268892 4.968 4.967542375268892 4.967542375268892 4.967542375268892 4.967542375268892 4.967542375268892 280306.46875 686120.0 1 1 1 1 1 1 1 1 1 1 1 1 4.0952999984256166E-4 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 9.6947000020009E-4 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 0.619066857669142 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4655012987060736 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 11.791429962972629 0.0 0.0 0.0 0.0 0.0 14.492680730274051 0.0 0.0 0.0 0.0 0.0 C C 39.304766543242096 0.0 0.0 0.0 0.0 0.0 48.30893576758017 0.0 0.0 0.0 0.0 0.0 0.99 0.99 686163.06 477.61065239365263 16.3374 12.9489 14 0 0 0 0 0 13 0 0 0 0 0 -0 SM(d32:1)+H SM(d32:1)+H SM (d32:1) (d32:1) 675.54355247 C37 H76 O6 N2 P1 5.5734890977E7 1.9534565866E7 4.947665155490477 16.08640972554568 13.332506276619071 0.98 3097.365903386462 4.4350381943E7 0.0 0.0 0.0 0.0 0.0 5.5734890977E7 0.0 0.0 0.0 0.0 0.0 1.6168643778E7 0.0 0.0 0.0 0.0 0.0 1.9534565866E7 0.0 0.0 0.0 0.0 0.0 4.952 4.951 0.018 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.93 1.0 281 -1416 -1415 -1414 -1413 -1412 334 -1411 -1410 -1409 -1408 -1407 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 675.543007 675.543261 4.952 4.947665155490477 4.947665155490477 4.947665155490477 4.947665155490477 4.947665155490477 4.951 4.947665155490477 4.947665155490477 4.947665155490477 4.947665155490477 4.947665155490477 433975.46875 201885.515625 1 1 1 1 1 1 1 1 1 1 1 1 5.454700000200319E-4 675.54355247 675.54355247 675.54355247 675.54355247 675.54355247 2.914699999791992E-4 675.54355247 675.54355247 675.54355247 675.54355247 675.54355247 0.8074534913783452 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4314599686630019 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 15.255263477440394 0.0 0.0 0.0 0.0 0.0 20.16387776963839 0.0 0.0 0.0 0.0 0.0 C C 50.85087825813465 0.0 0.0 0.0 0.0 0.0 50.409694424095974 0.0 0.0 0.0 0.0 0.0 0.94 0.98 3187.852458101881 3097.365903386462 80.5144 70.1035 9 0 0 0 0 0 14 0 0 0 0 0 -0 SM(d33:1)+H SM(d33:1)+H SM (d33:1) (d33:1) 689.5592024700001 C38 H78 O6 N2 P1 1.1429166345E7 4512792.59 4.932368134179071 0.362513500430724 1.2946080710949723 0.94 5927260.5 1.1370722079E7 0.0 0.0 0.0 0.0 0.0 1.1429166345E7 0.0 0.0 0.0 0.0 0.0 4430919.511 0.0 0.0 0.0 0.0 0.0 4512792.59 0.0 0.0 0.0 0.0 0.0 4.938 4.941 0.016 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.9 0.89 280 -1426 -1425 -1424 -1423 -1422 289 -1421 -1420 -1419 -1418 -1417 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 689.558968 689.559115 4.938 4.932368134179071 4.932368134179071 4.932368134179071 4.932368134179071 4.932368134179071 4.941 4.932368134179071 4.932368134179071 4.932368134179071 4.932368134179071 4.932368134179071 418157.71875 262384.6875 1 1 1 1 1 1 1 1 1 1 1 1 2.3447000000942353E-4 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 8.747000003950234E-5 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 0.34002881720605327 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.12684915193095084 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.983065688928189 0.0 0.0 0.0 0.0 0.0 11.11423496008305 0.0 0.0 0.0 0.0 0.0 C C 43.27688562976063 0.0 0.0 0.0 0.0 0.0 37.047449866943495 0.0 0.0 0.0 0.0 0.0 0.93 0.94 5598443.5 5927260.5 56.5456 78.7062 10 0 0 0 0 0 10 0 0 0 0 0 -0 SM(d34:1)+H SM(d34:1)+H SM (d34:1) (d34:1) 703.5748524700001 C39 H80 O6 N2 P1 5.2372746593E7 2.0074614564E7 4.93 1.2951277267173191 2.4212791675656797 0.96 678.0015675971664 5.1422199125E7 0.0 0.0 0.0 0.0 0.0 5.2372746593E7 0.0 0.0 0.0 0.0 0.0 2.0074614564E7 0.0 0.0 0.0 0.0 0.0 1.9398789265E7 0.0 0.0 0.0 0.0 0.0 4.927 4.929 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.88 0.9 -1437 -1436 -1435 -1434 -1433 -1432 326 -1431 -1430 -1429 -1428 -1427 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 703.57485 703.573711 4.927 4.93 4.93 4.93 4.93 4.93 4.929 4.93 4.93 4.93 4.93 4.93 1781689.5 1 1 1 1 1 1 1 1 1 1 1 1 2.47000014041987E-6 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 0.0011414700001068923 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 0.0035106430136730747 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6223860135131303 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 19.002496940796288 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 47.50624235199072 0.0 0.0 0.0 0.0 0.0 0.97 0.96 946.9120293849406 678.0015675971664 18.3029 25.5351 11 0 0 0 0 0 10 0 0 0 0 0 -0 SM(d34:2)+H SM(d34:2)+H SM (d34:2) (d34:2) 701.5592024700001 C39 H78 O6 N2 P1 1699976.04 618021.273 4.914399473113788 1.4774255642462224 6.0818937097735235 0.96 721954.06 1699976.04 0.0 0.0 0.0 0.0 0.0 1664824.053 0.0 0.0 0.0 0.0 0.0 618021.273 0.0 0.0 0.0 0.0 0.0 567056.434 0.0 0.0 0.0 0.0 0.0 4.913 4.916 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.91 0.93 292 -1447 -1446 -1445 -1444 -1443 303 -1442 -1441 -1440 -1439 -1438 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 701.558899 701.558777 4.913 4.914399473113788 4.914399473113788 4.914399473113788 4.914399473113788 4.914399473113788 4.916 4.914399473113788 4.914399473113788 4.914399473113788 4.914399473113788 4.914399473113788 618938.1875 622223.75 1 1 1 1 1 1 1 1 1 1 1 1 3.0347000006258895E-4 701.5592024700001 701.5592024700001 701.5592024700001 701.5592024700001 701.5592024700001 4.254700000956291E-4 701.5592024700001 701.5592024700001 701.5592024700001 701.5592024700001 701.5592024700001 0.4325650622130723 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6064634297400195 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.246710814739306 0.0 0.0 0.0 0.0 0.0 14.430595496458306 0.0 0.0 0.0 0.0 0.0 C C 40.82236938246435 0.0 0.0 0.0 0.0 0.0 48.10198498819435 0.0 0.0 0.0 0.0 0.0 0.96 0.95 721954.06 314.254125494316 18.4707 18.2564 11 0 0 0 0 0 11 0 0 0 0 0 -0 SM(d34:4)+H SM(d34:4)+H SM (d34:4) (d34:4) 697.5279024700002 C39 H74 O6 N2 P1 2070920.06 789929.42 4.918444559143113 1.344335227300578 5.395425723910814 0.98 99.56754228826654 2070920.06 0.0 0.0 0.0 0.0 0.0 2031918.942 0.0 0.0 0.0 0.0 0.0 789929.42 0.0 0.0 0.0 0.0 0.0 731870.587 0.0 0.0 0.0 0.0 0.0 4.92 4.922 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.75 0.76 293 -1457 -1456 -1455 -1454 -1453 304 -1452 -1451 -1450 -1449 -1448 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 697.527588 697.526129 4.92 4.918444559143113 4.918444559143113 4.918444559143113 4.918444559143113 4.918444559143113 4.922 4.918444559143113 4.918444559143113 4.918444559143113 4.918444559143113 4.918444559143113 457551.75 933810.0 1 1 1 1 1 1 1 1 1 1 1 1 3.1447000014850346E-4 697.5279024700002 697.5279024700002 697.5279024700002 697.5279024700002 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(d36:1) 731.60615247 C41 H84 O6 N2 P1 3160211.914 697387.1000000001 4.834 43.757399440633385 2.5873733482805004 0.98 62.39864809395812 3160211.914 0.0 0.0 0.0 0.0 0.0 1666707.386100013 0.0 0.0 0.0 0.0 0.0 672327.497 0.0 0.0 0.0 0.0 0.0 697387.1000000001 0.0 0.0 0.0 0.0 0.0 4.833 4.837 0.037 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.84 -1478 -1477 -1476 -1475 -1474 -1473 323 -1472 -1471 -1470 -1469 -1468 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 731.60615 731.605045 4.833 4.834 4.834 4.834 4.834 4.834 4.837 4.834 4.834 4.834 4.834 4.834 433637.0 1 1 1 1 1 1 1 1 1 1 1 1 2.4700000267330324E-6 731.60615247 731.60615247 731.60615247 731.60615247 731.60615247 0.0011074699999653603 731.60615247 731.60615247 731.60615247 731.60615247 731.60615247 0.0033761334816471717 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5137516219982483 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 19.729963024359787 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 49.32490756089946 0.0 0.0 0.0 0.0 0.0 0.98 0.0 62.39864809395812 166.3636297162801 27.2531 20.7837 6 0 0 0 0 0 7 0 0 0 0 0 -0 SM(d36:2)+H SM(d36:2)+H SM (d36:2) (d36:2) 729.5905024700002 C41 H82 O6 N2 P1 2462209.49 733962.987 4.903515299447872 15.977839295538118 5.128194801294041 0.99 511.3927651328876 1962323.993 0.0 0.0 0.0 0.0 0.0 2462209.49 0.0 0.0 0.0 0.0 0.0 682595.99 0.0 0.0 0.0 0.0 0.0 733962.987 0.0 0.0 0.0 0.0 0.0 4.905 4.902 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 1.0 294 -1488 -1487 -1486 -1485 -1484 299 -1483 -1482 -1481 -1480 -1479 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 729.589164 729.590088 4.905 4.903515299447872 4.903515299447872 4.903515299447872 4.903515299447872 4.903515299447872 4.902 4.903515299447872 4.903515299447872 4.903515299447872 4.903515299447872 4.903515299447872 565125.0 696612.875 1 1 1 1 1 1 1 1 1 1 1 1 0.0013384700001779493 729.5905024700002 729.5905024700002 729.5905024700002 729.5905024700002 729.5905024700002 4.144700001234014E-4 729.5905024700002 729.5905024700002 729.5905024700002 729.5905024700002 729.5905024700002 1.8345496489422648 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5680857943191824 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 14.152620622559335 0.0 0.0 0.0 0.0 0.0 12.270479575189324 0.0 0.0 0.0 0.0 0.0 C C 47.17540207519778 0.0 0.0 0.0 0.0 0.0 40.901598583964415 0.0 0.0 0.0 0.0 0.0 0.99 0.99 483.60407647907647 511.3927651328876 16.1339 20.1708 13 0 0 0 0 0 15 0 0 0 0 0 -0 SM(d36:4)+H SM(d36:4)+H SM (d36:4) (d36:4) 725.5592024700001 C41 H78 O6 N2 P1 1445625.945 380615.725 4.91 1.796895029665975 2.200241211927587 0.99 531.9012011743491 1445625.945 0.0 0.0 0.0 0.0 0.0 1409350.707 0.0 0.0 0.0 0.0 0.0 368953.88 0.0 0.0 0.0 0.0 0.0 380615.725 0.0 0.0 0.0 0.0 0.0 4.908 4.909 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1499 -1498 -1497 -1496 -1495 -1494 300 -1493 -1492 -1491 -1490 -1489 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 725.5592 725.558373 4.908 4.91 4.91 4.91 4.91 4.91 4.909 4.91 4.91 4.91 4.91 4.91 258768.03125 1 1 1 1 1 1 1 1 1 1 1 1 2.4700000267330324E-6 725.5592024700001 725.5592024700001 725.5592024700001 725.5592024700001 725.5592024700001 8.294700000988087E-4 725.5592024700001 725.5592024700001 725.5592024700001 725.5592024700001 725.5592024700001 0.003404270827693293 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1432147745836152 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.785598240238777 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 33.92799120119388 0.0 0.0 0.0 0.0 0.0 0.99 0.99 531.9012011743491 790.3212288179644 13.2668 16.7701 18 0 0 0 0 0 16 0 0 0 0 0 -0 SM(d37:1)+H SM(d37:1)+H SM (d37:1) (d37:1) 745.62180247 C42 H86 O6 N2 P1 2005765.307 660073.863 4.896971288561792 7.61533929682855 3.3558623073558254 0.97 705731.56 2005765.307 0.0 0.0 0.0 0.0 0.0 1800787.824 0.0 0.0 0.0 0.0 0.0 660073.863 0.0 0.0 0.0 0.0 0.0 629473.51 0.0 0.0 0.0 0.0 0.0 4.897 4.897 0.022 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.87 0.9 288 -1509 -1508 -1507 -1506 -1505 297 -1504 -1503 -1502 -1501 -1500 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 745.621387 745.620682 4.897 4.896971288561792 4.896971288561792 4.896971288561792 4.896971288561792 4.896971288561792 4.897 4.896971288561792 4.896971288561792 4.896971288561792 4.896971288561792 4.896971288561792 680239.9375 370624.5625 1 1 1 1 1 1 1 1 1 1 1 1 4.154700000071898E-4 745.62180247 745.62180247 745.62180247 745.62180247 745.62180247 0.0011204700000462253 745.62180247 745.62180247 745.62180247 745.62180247 745.62180247 0.5572127835195728 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5027323454524484 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.699416546362496 0.0 0.0 0.0 0.0 0.0 12.727539701253601 0.0 0.0 0.0 0.0 0.0 C C 44.24854136590624 0.0 0.0 0.0 0.0 0.0 42.425132337512004 0.0 0.0 0.0 0.0 0.0 0.97 0.96 705731.56 204.9823738785364 16.7474 15.7632 13 0 0 0 0 0 13 0 0 0 0 0 -0 SM(d38:1)+H SM(d38:1)+H SM (d38:1) (d38:1) 759.6374524700001 C43 H88 O6 N2 P1 3374555.577 941819.1900000001 4.810901047458755 38.42588056006765 1.6779183827456068 0.98 10.544856520474045 3374555.577 0.0 0.0 0.0 0.0 0.0 1932550.9973999953 0.0 0.0 0.0 0.0 0.0 919732.485 0.0 0.0 0.0 0.0 0.0 941819.1900000001 0.0 0.0 0.0 0.0 0.0 4.809 4.811 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.88 0.86 267 -1519 -1518 -1517 -1516 -1515 276 -1514 -1513 -1512 -1511 -1510 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 759.635936 759.636798 4.809 4.810901047458755 4.810901047458755 4.810901047458755 4.810901047458755 4.810901047458755 4.811 4.810901047458755 4.810901047458755 4.810901047458755 4.810901047458755 4.810901047458755 825539.8125 729778.625 1 1 1 1 1 1 1 1 1 1 1 1 0.001516470000069603 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 6.544700000858938E-4 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 1.9963075742760221 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.861555730247174 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.752507854696276 0.0 0.0 0.0 0.0 0.0 18.895610002376312 0.0 0.0 0.0 0.0 0.0 C C 44.3812696367407 0.0 0.0 0.0 0.0 0.0 47.239025005940775 0.0 0.0 0.0 0.0 0.0 0.98 0.0 10.544856520474045 4.57613441430711 47.3194 17.3237 5 0 0 0 0 0 8 0 0 0 0 0 -0 SM(d38:2)+H SM(d38:2)+H SM (d38:2) (d38:2) 757.62180247 C43 H86 O6 N2 P1 8001844.993 2152159.313 4.884 3.563553259655034 5.229768288224784 0.98 2131287.75 8001844.993 0.0 0.0 0.0 0.0 0.0 7608493.7 0.0 0.0 0.0 0.0 0.0 2152159.313 0.0 0.0 0.0 0.0 0.0 1998661.758 0.0 0.0 0.0 0.0 0.0 4.884 4.885 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 270 -1529 -1528 -1527 -1526 -1525 281 -1524 -1523 -1522 -1521 -1520 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 757.620999 757.620479 4.884 4.884 4.884 4.884 4.884 4.884 4.885 4.884 4.884 4.884 4.884 4.884 344027.8125 372195.96875 1 1 1 1 1 1 1 1 1 1 1 1 8.034700000507655E-4 757.62180247 757.62180247 757.62180247 757.62180247 757.62180247 0.001323469999988447 757.62180247 757.62180247 757.62180247 757.62180247 757.62180247 1.0605159426923711 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.746874226261266 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 13.19716101588064 0.0 0.0 0.0 0.0 0.0 12.595702415383764 0.0 0.0 0.0 0.0 0.0 C C 43.99053671960213 0.0 0.0 0.0 0.0 0.0 41.985674717945884 0.0 0.0 0.0 0.0 0.0 0.98 0.99 2131287.75 1881609.25 33.038 32.994 16 0 0 0 0 0 17 0 0 0 0 0 -0 SM(d38:4)+H SM(d38:4)+H SM (d38:4) (d38:4) 753.5905024700002 C43 H82 O6 N2 P1 1621421.57 566094.765 4.901 14.275766773828833 11.791705209607803 0.99 268.0280218503574 1324087.416 0.0 0.0 0.0 0.0 0.0 1621421.57 0.0 0.0 0.0 0.0 0.0 478958.296 0.0 0.0 0.0 0.0 0.0 566094.765 0.0 0.0 0.0 0.0 0.0 4.9 4.898 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 -1540 -1539 -1538 -1537 -1536 -1535 298 -1534 -1533 -1532 -1531 -1530 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 753.5905 753.589694 4.9 4.901 4.901 4.901 4.901 4.901 4.898 4.901 4.901 4.901 4.901 4.901 566295.5625 1 1 1 1 1 1 1 1 1 1 1 1 2.47000014041987E-6 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 8.084700001518286E-4 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 0.003277642343320534 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0728240304276038 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 14.744541922813916 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 49.148473076046386 0.0 0.0 0.0 0.0 0.0 0.99 0.99 72.6682059567213 268.0280218503574 16.8819 15.8999 11 0 0 0 0 0 15 0 0 0 0 0 -0 SM(d39:1)+H SM(d39:1)+H SM (d39:1) (d39:1) 773.6531024700001 C44 H90 O6 N2 P1 2964724.183 677665.027 4.878507246108735 2.0902322128097874 1.8435321466489751 0.96 1243.7564197714114 2964724.183 0.0 0.0 0.0 0.0 0.0 2878362.349 0.0 0.0 0.0 0.0 0.0 677665.027 0.0 0.0 0.0 0.0 0.0 660224.644 0.0 0.0 0.0 0.0 0.0 4.878 4.876 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 283 -1550 -1549 -1548 -1547 -1546 293 -1545 -1544 -1543 -1542 -1541 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 773.651711 773.651699 4.878 4.878507246108735 4.878507246108735 4.878507246108735 4.878507246108735 4.878507246108735 4.876 4.878507246108735 4.878507246108735 4.878507246108735 4.878507246108735 4.878507246108735 554118.6875 613011.75 1 1 1 1 1 1 1 1 1 1 1 1 0.001391470000157824 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 0.0014034700001275269 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 1.7985709560465193 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.8140817837435728 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 13.780156400221616 0.0 0.0 0.0 0.0 0.0 12.610440634513397 0.0 0.0 0.0 0.0 0.0 C C 45.933854667405384 0.0 0.0 0.0 0.0 0.0 42.034802115044656 0.0 0.0 0.0 0.0 0.0 0.96 0.97 1243.7564197714114 653482.13 21.0526 31.0439 21 0 0 0 0 0 20 0 0 0 0 0 -0 SM(d40:1)+H SM(d40:1)+H SM (d40:1) (d40:1) 787.6687524700002 C45 H92 O6 N2 P1 8241433.897 1916238.592 4.860528314971107 4.4466821880447895 0.5549816776471822 0.95 334.3979686747109 8241433.897 0.0 0.0 0.0 0.0 0.0 7738965.533 0.0 0.0 0.0 0.0 0.0 1916238.592 0.0 0.0 0.0 0.0 0.0 1901257.542 0.0 0.0 0.0 0.0 0.0 4.866 4.871 0.026 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.77 0.75 297 -1560 -1559 -1558 -1557 -1556 308 -1555 -1554 -1553 -1552 -1551 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 787.666977 787.667173 4.866 4.860528314971107 4.860528314971107 4.860528314971107 4.860528314971107 4.860528314971107 4.871 4.860528314971107 4.860528314971107 4.860528314971107 4.860528314971107 4.860528314971107 570941.25 489314.6875 1 1 1 1 1 1 1 1 1 1 1 1 0.0017754700002114987 787.6687524700002 787.6687524700002 787.6687524700002 787.6687524700002 787.6687524700002 0.001579470000137917 787.6687524700002 787.6687524700002 787.6687524700002 787.6687524700002 787.6687524700002 2.2540820549804925 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.005246488685704 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.152805521327316 0.0 0.0 0.0 0.0 0.0 16.748930746160898 0.0 0.0 0.0 0.0 0.0 C C 40.50935173775772 0.0 0.0 0.0 0.0 0.0 41.87232686540224 0.0 0.0 0.0 0.0 0.0 0.95 0.98 334.3979686747109 352.3303216338427 42.726 29.9497 23 0 0 0 0 0 22 0 0 0 0 0 -0 SM(d40:2)+H SM(d40:2)+H SM (d40:2) (d40:2) 785.6531024700001 C45 H90 O6 N2 P1 9192052.814 1713967.841 4.834515051636187 1.059568835178179 4.407060228889384 0.93 1587229.63 9192052.814 0.0 0.0 0.0 0.0 0.0 9055338.195 0.0 0.0 0.0 0.0 0.0 1610372.675 0.0 0.0 0.0 0.0 0.0 1713967.841 0.0 0.0 0.0 0.0 0.0 4.832 4.834 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 265 -1570 -1569 -1568 -1567 -1566 273 -1565 -1564 -1563 -1562 -1561 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 785.653071 785.652489 4.832 4.834515051636187 4.834515051636187 4.834515051636187 4.834515051636187 4.834515051636187 4.834 4.834515051636187 4.834515051636187 4.834515051636187 4.834515051636187 4.834515051636187 295222.53125 280548.75 1 1 1 1 1 1 1 1 1 1 1 1 3.1470000180888746E-5 785.6531024700001 785.6531024700001 785.6531024700001 785.6531024700001 785.6531024700001 6.134700001894089E-4 785.6531024700001 785.6531024700001 785.6531024700001 785.6531024700001 785.6531024700001 0.04005584663504898 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7808408039893586 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 17.379836348297207 0.0 0.0 0.0 0.0 0.0 17.864440838921144 0.0 0.0 0.0 0.0 0.0 C C 43.449590870743016 0.0 0.0 0.0 0.0 0.0 44.661102097302866 0.0 0.0 0.0 0.0 0.0 0.93 0.94 1587229.63 27867.349435590968 24.529 14.3317 24 0 0 0 0 0 22 0 0 0 0 0 -0 SM(d40:4)+H SM(d40:4)+H SM (d40:4) (d40:4) 781.62180247 C45 H86 O6 N2 P1 960163.9730999983 308576.78 4.807518940478875 3.3590852609598953 7.361922436585753 0.7789546677238504 21.62827744563795 960163.9730999983 0.0 0.0 0.0 0.0 0.0 915609.9903000018 0.0 0.0 0.0 0.0 0.0 308576.78 0.0 0.0 0.0 0.0 0.0 278039.5 0.0 0.0 0.0 0.0 0.0 4.811 4.811 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.89 275 -1580 -1579 -1578 -1577 -1576 278 -1575 -1574 -1573 -1572 -1571 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 781.621317 781.621281 4.811 4.807518940478875 4.807518940478875 4.807518940478875 4.807518940478875 4.807518940478875 4.811 4.807518940478875 4.807518940478875 4.807518940478875 4.807518940478875 4.807518940478875 220099.671875 249246.25 1 1 1 1 1 1 1 1 1 1 1 1 4.854700000578305E-4 781.62180247 781.62180247 781.62180247 781.62180247 781.62180247 5.21470000080626E-4 781.62180247 781.62180247 781.62180247 781.62180247 781.62180247 0.6211060112751443 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6671640919338876 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 10.471039934861388 0.0 0.0 0.0 0.0 0.0 8.68738986662364 0.0 0.0 0.0 0.0 0.0 C C 34.90346644953796 0.0 0.0 0.0 0.0 0.0 43.4369493331182 0.0 0.0 0.0 0.0 0.0 0.7789546677238504 0.7318279536543107 21.62827744563795 2356.969899949127 29.8334 41.1194 10 0 0 0 0 0 10 0 0 0 0 0 -0 SM(d42:4)+H SM(d42:4)+H SM (d42:4) (d42:4) 809.6531024700001 C47 H90 O6 N2 P1 1683896.226 520992.634 4.864464425665216 18.747001578693677 16.820736579358833 0.94 517458.03 1289710.937 0.0 0.0 0.0 0.0 0.0 1683896.226 0.0 0.0 0.0 0.0 0.0 410232.22 0.0 0.0 0.0 0.0 0.0 520992.634 0.0 0.0 0.0 0.0 0.0 4.868 4.863 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 1.0 282 -1590 -1589 -1588 -1587 -1586 292 -1585 -1584 -1583 -1582 -1581 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 809.651122 809.651058 4.868 4.864464425665216 4.864464425665216 4.864464425665216 4.864464425665216 4.864464425665216 4.863 4.864464425665216 4.864464425665216 4.864464425665216 4.864464425665216 4.864464425665216 452062.90625 474089.375 1 1 1 1 1 1 1 1 1 1 1 1 0.001980470000148671 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 0.002044470000100773 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 2.446072267378303 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.525118465999488 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 19.88230589539268 0.0 0.0 0.0 0.0 0.0 13.268627736639035 0.0 0.0 0.0 0.0 0.0 C C 49.7057647384817 0.0 0.0 0.0 0.0 0.0 44.228759122130114 0.0 0.0 0.0 0.0 0.0 0.93 0.94 351.1115159953021 517458.03 16.487 16.8239 12 0 0 0 0 0 16 0 0 0 0 0 -0 TG(12:0_18:3_22:6)+NH4 TG(52:9)+NH4 TG (12:0_18:3_22:6) (12:0) (18:3) (22:6) 862.69191547 C55 H92 O6 N1 3954070.622 2415552.714 0.411 4.431144261895543 6.6589904754503255 0.9 355.43211592285786 3713813.413 0.0 0.0 0.0 0.0 0.0 3954070.622 0.0 0.0 0.0 0.0 0.0 2415552.714 0.0 0.0 0.0 0.0 0.0 2198303.864 0.0 0.0 0.0 0.0 0.0 0.41 0.413 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 3 -1601 -1600 -1599 -1598 -1597 -1596 -1595 -1594 -1593 -1592 -1591 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 862.689145 862.69192 0.41 0.411 0.411 0.411 0.411 0.411 0.413 0.411 0.411 0.411 0.411 0.411 2301121.75 1 1 1 1 1 1 1 1 1 1 1 1 0.002770469999973102 862.69191547 862.69191547 862.69191547 862.69191547 862.69191547 4.5299999555936665E-6 862.69191547 862.69191547 862.69191547 862.69191547 862.69191547 3.211424554110644 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005251005456711268 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 15.896029715131036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 52.48031779806147 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 0.9 855.2959003640315 355.43211592285786 49.6046 38.1445 7 0 0 0 0 0 7 0 0 0 0 0 -0 WE(3:0_18:1)+NH4 WE(21:1)+NH4 WE (3:0_18:1) (3:0) (18:1) 342.33665547 H44 C21 O2 N1 3716168.292 233436.981 4.814 12.863866220658062 4.068491670915562 0.98 18.361962723269354 0.0 3716168.292 0.0 0.0 0.0 0.0 0.0 3096481.053 0.0 0.0 0.0 0.0 0.0 233436.981 0.0 0.0 0.0 0.0 0.0 220381.274 0.0 0.0 0.0 0.0 4.837 4.812 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1612 -1611 -1610 -1609 -1608 -1607 -1606 269 -1605 -1604 -1603 -1602 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 342.33666 342.335861 4.814 4.837 4.814 4.814 4.814 4.814 4.814 4.812 4.814 4.814 4.814 4.814 114154.742188 1 1 1 1 1 1 1 1 1 1 1 1 342.33665547 4.530000012437085E-6 342.33665547 342.33665547 342.33665547 342.33665547 342.33665547 7.944699999598015E-4 342.33665547 342.33665547 342.33665547 342.33665547 1000000.0 0.01323258827255226 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3207272352096204 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.581947317738873 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 53.1614030260845 0.0 0.0 0.0 0.0 0.98 0.94 18.361962723269354 7.747158031188657 11.0754 10.2555 0 74 0 0 0 0 0 63 0 0 0 0 diff --git a/inst/extdata/daphnia/LIPIDS_POS_EL_CD.xlsx b/inst/extdata/daphnia/LIPIDS_POS_EL_CD.xlsx deleted file mode 100644 index a7cb2a5..0000000 Binary files a/inst/extdata/daphnia/LIPIDS_POS_EL_CD.xlsx and /dev/null differ diff --git a/inst/extdata/daphnia/LIPIDS_POS_EL_CD_comp.xlsx b/inst/extdata/daphnia/LIPIDS_POS_EL_CD_comp.xlsx deleted file mode 100644 index e9d57b9..0000000 Binary files a/inst/extdata/daphnia/LIPIDS_POS_EL_CD_comp.xlsx and /dev/null differ diff --git a/inst/extdata/daphnia/LIPIDS_POS_EL_LS.txt b/inst/extdata/daphnia/LIPIDS_POS_EL_LS.txt deleted file mode 100644 index 538583d..0000000 --- a/inst/extdata/daphnia/LIPIDS_POS_EL_LS.txt +++ /dev/null @@ -1,617 +0,0 @@ -#[c-1]:QC33_MSMS_EL_1000_2000_lp.raw -#[c-10]:QC24_MSMS_IL_355_460_lp.raw -#[c-11]:QC23_MSMS_IL_290_365_lp.raw -#[c-12]:QC22_MSMS_IL_150_300_lp.raw -#[c-2]:QC32_MSMS_EL_850_1010_lp.raw -#[c-3]:QC31_MSMS_EL_450_860_lp.raw -#[c-4]:QC30_MSMS_EL_355_460_lp.raw -#[c-5]:QC29_MSMS_EL_290_365_lp.raw -#[c-6]:QC28_MSMS_EL_150_300_lp.raw -#[c-7]:QC27_MSMS_IL_1000_2000_lp.raw -#[c-8]:QC26_MSMS_IL_850_1010_lp.raw -#[c-9]:QC25_MSMS_IL_450_860_lp.raw -#normalize base: -#control group:c -#toprank filter:true -#mScoreThreshold:5.0 -#cScoreThreshold:2.0 - -Rej. LipidIon LipidGroup Class FattyAcid FA1 FA2 FA3 CalcMz IonFormula GroupArea[c] GroupHeight[c] GroupTopPos[c] AreaRSD[c] HeightRSD[c] GroupPQ[c] GroupS/N[c] Area[c-1] Area[c-2] Area[c-3] Area[c-4] Area[c-5] Area[c-6] Area[c-7] Area[c-8] Area[c-9] Area[c-10] Area[c-11] Area[c-12] Height[c-1] Height[c-2] Height[c-3] Height[c-4] Height[c-5] Height[c-6] Height[c-7] Height[c-8] Height[c-9] Height[c-10] Height[c-11] Height[c-12] NormArea[c-1] NormArea[c-2] NormArea[c-3] NormArea[c-4] NormArea[c-5] NormArea[c-6] NormArea[c-7] NormArea[c-8] NormArea[c-9] NormArea[c-10] NormArea[c-11] NormArea[c-12] NormHeight[c-1] NormHeight[c-2] NormHeight[c-3] NormHeight[c-4] NormHeight[c-5] NormHeight[c-6] NormHeight[c-7] NormHeight[c-8] NormHeight[c-9] NormHeight[c-10] NormHeight[c-11] NormHeight[c-12] TopPos[c-1] TopPos[c-2] TopPos[c-3] TopPos[c-4] TopPos[c-5] TopPos[c-6] TopPos[c-7] TopPos[c-8] TopPos[c-9] TopPos[c-10] TopPos[c-11] TopPos[c-12] Hwhm(L)[c-1] Hwhm(L)[c-2] Hwhm(L)[c-3] Hwhm(L)[c-4] Hwhm(L)[c-5] Hwhm(L)[c-6] Hwhm(L)[c-7] Hwhm(L)[c-8] Hwhm(L)[c-9] Hwhm(L)[c-10] Hwhm(L)[c-11] Hwhm(L)[c-12] Hwhm(R)[c-1] Hwhm(R)[c-2] Hwhm(R)[c-3] Hwhm(R)[c-4] Hwhm(R)[c-5] Hwhm(R)[c-6] Hwhm(R)[c-7] Hwhm(R)[c-8] Hwhm(R)[c-9] Hwhm(R)[c-10] Hwhm(R)[c-11] Hwhm(R)[c-12] AreaScore[c-1] AreaScore[c-2] AreaScore[c-3] AreaScore[c-4] AreaScore[c-5] AreaScore[c-6] AreaScore[c-7] AreaScore[c-8] AreaScore[c-9] AreaScore[c-10] AreaScore[c-11] AreaScore[c-12] DataId[c-1] DataId[c-2] DataId[c-3] DataId[c-4] DataId[c-5] DataId[c-6] DataId[c-7] DataId[c-8] DataId[c-9] DataId[c-10] DataId[c-11] DataId[c-12] Scan[c-1] Scan[c-2] Scan[c-3] Scan[c-4] Scan[c-5] Scan[c-6] Scan[c-7] Scan[c-8] Scan[c-9] Scan[c-10] Scan[c-11] Scan[c-12] ObsMz[c-1] ObsMz[c-2] ObsMz[c-3] ObsMz[c-4] ObsMz[c-5] ObsMz[c-6] ObsMz[c-7] ObsMz[c-8] ObsMz[c-9] ObsMz[c-10] ObsMz[c-11] ObsMz[c-12] Rt[c-1] Rt[c-2] Rt[c-3] Rt[c-4] Rt[c-5] Rt[c-6] Rt[c-7] Rt[c-8] Rt[c-9] Rt[c-10] Rt[c-11] Rt[c-12] It.[c-1] It.[c-2] It.[c-3] It.[c-4] It.[c-5] It.[c-6] It.[c-7] It.[c-8] It.[c-9] It.[c-10] It.[c-11] It.[c-12] z[c-1] z[c-2] z[c-3] z[c-4] z[c-5] z[c-6] z[c-7] z[c-8] z[c-9] z[c-10] z[c-11] z[c-12] Delta(Da)[c-1] Delta(Da)[c-2] Delta(Da)[c-3] Delta(Da)[c-4] Delta(Da)[c-5] Delta(Da)[c-6] Delta(Da)[c-7] Delta(Da)[c-8] Delta(Da)[c-9] Delta(Da)[c-10] Delta(Da)[c-11] Delta(Da)[c-12] Delta(ppm)[c-1] Delta(ppm)[c-2] Delta(ppm)[c-3] Delta(ppm)[c-4] Delta(ppm)[c-5] Delta(ppm)[c-6] Delta(ppm)[c-7] Delta(ppm)[c-8] Delta(ppm)[c-9] Delta(ppm)[c-10] Delta(ppm)[c-11] Delta(ppm)[c-12] mScore[c-1] mScore[c-2] mScore[c-3] mScore[c-4] mScore[c-5] mScore[c-6] mScore[c-7] mScore[c-8] mScore[c-9] mScore[c-10] mScore[c-11] mScore[c-12] Grade[c-1] Grade[c-2] Grade[c-3] Grade[c-4] Grade[c-5] Grade[c-6] Grade[c-7] Grade[c-8] Grade[c-9] Grade[c-10] Grade[c-11] Grade[c-12] Occupy[c-1] Occupy[c-2] Occupy[c-3] Occupy[c-4] Occupy[c-5] Occupy[c-6] Occupy[c-7] Occupy[c-8] Occupy[c-9] Occupy[c-10] Occupy[c-11] Occupy[c-12] PQ[c-1] PQ[c-2] PQ[c-3] PQ[c-4] PQ[c-5] PQ[c-6] PQ[c-7] PQ[c-8] PQ[c-9] PQ[c-10] PQ[c-11] PQ[c-12] S/N[c-1] S/N[c-2] S/N[c-3] S/N[c-4] S/N[c-5] S/N[c-6] S/N[c-7] S/N[c-8] S/N[c-9] S/N[c-10] S/N[c-11] S/N[c-12] IntensityRatio[c-1] IntensityRatio[c-2] IntensityRatio[c-3] IntensityRatio[c-4] IntensityRatio[c-5] IntensityRatio[c-6] IntensityRatio[c-7] IntensityRatio[c-8] IntensityRatio[c-9] IntensityRatio[c-10] IntensityRatio[c-11] IntensityRatio[c-12] PeakDataPoint[c-1] PeakDataPoint[c-2] PeakDataPoint[c-3] PeakDataPoint[c-4] PeakDataPoint[c-5] PeakDataPoint[c-6] PeakDataPoint[c-7] PeakDataPoint[c-8] PeakDataPoint[c-9] PeakDataPoint[c-10] PeakDataPoint[c-11] PeakDataPoint[c-12] -0 AcCa(14:0)+H AcCa(14:0)+H AcCa (14:0) (14:0) 372.31083547000003 C21 H42 O4 N1 6014268.257 806799.611 1.572 3.1836467324131563 5.549376162412643 0.82 42.703156015793596 0.0 0.0 0.0 5749446.085 0.0 0.0 0.0 0.0 0.0 6014268.257 0.0 0.0 0.0 0.0 0.0 745872.725 0.0 0.0 0.0 0.0 0.0 806799.611 0.0 0.0 1.573 1.558 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -11 -10 -9 250 -8 -7 -6 -5 -4 -3 -2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 372.311084 372.31084 1.572 1.572 1.572 1.573 1.572 1.572 1.572 1.572 1.572 1.558 1.572 1.572 381632.375 1 1 1 1 1 1 1 1 1 1 1 1 372.31083547000003 372.31083547000003 372.31083547000003 2.485299999648305E-4 372.31083547000003 372.31083547000003 372.31083547000003 372.31083547000003 372.31083547000003 4.5299999555936665E-6 372.31083547000003 372.31083547000003 1000000.0 1000000.0 1000000.0 0.6675336205326651 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.012167252532081311 1000000.0 1000000.0 0.0 0.0 0.0 11.893857363978368 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 59.46928681989184 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.82 23.323543028868922 42.703156015793596 19.9893 22.5437 0 0 0 37 0 0 0 0 0 34 0 0 -0 AcCa(15:0)+H AcCa(15:0)+H AcCa (15:0) (15:0) 386.3264854700001 C22 H44 O4 N1 2563505.947 246073.593 1.904 3.67076025345534 4.752549691196964 0.67 8.902540188369215 0.0 0.0 0.0 2433795.03 0.0 0.0 0.0 0.0 0.0 2563505.947 0.0 0.0 0.0 0.0 0.0 230072.42 0.0 0.0 0.0 0.0 0.0 246073.593 0.0 0.0 1.921 1.906 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -22 -21 -20 -19 -18 -17 -16 -15 -14 298 -13 -12 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 386.32649 386.32641 1.904 1.904 1.904 1.921 1.904 1.904 1.904 1.904 1.904 1.906 1.904 1.904 219888.515625 1 1 1 1 1 1 1 1 1 1 1 1 386.3264854700001 386.3264854700001 386.3264854700001 4.529999898750248E-6 386.3264854700001 386.3264854700001 386.3264854700001 386.3264854700001 386.3264854700001 7.547000006979943E-5 386.3264854700001 386.3264854700001 1000000.0 1000000.0 1000000.0 0.011725833120758223 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.19535290203565397 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.24179222158157 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 51.20896110790785 0.0 0.0 0.95 0.67 6.090831838258653 8.902540188369215 7.6451 10.5088 0 0 0 69 0 0 0 0 0 62 0 0 -0 AcCa(16:0)+H AcCa(16:0)+H AcCa (16:0) (16:0) 400.34213547 C23 H46 O4 N1 4.2486219231E7 4386218.186 2.507 3.358544686905297 0.41095207400293027 0.93 231.6677582243378 0.0 0.0 0.0 4.0515063498E7 0.0 0.0 0.0 0.0 0.0 4.2486219231E7 0.0 0.0 0.0 0.0 0.0 4386218.186 0.0 0.0 0.0 0.0 0.0 4360800.487 0.0 0.0 2.511 2.506 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -33 -32 -31 -30 -29 -28 -27 -26 -25 339 -24 -23 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 400.34214 400.341705 2.507 2.507 2.507 2.511 2.507 2.507 2.507 2.507 2.507 2.506 2.507 2.507 3987026.0 1 1 1 1 1 1 1 1 1 1 1 1 400.34213547 400.34213547 400.34213547 4.5299999555936665E-6 400.34213547 400.34213547 400.34213547 400.34213547 400.34213547 4.3047000002616187E-4 400.34213547 400.34213547 1000000.0 1000000.0 1000000.0 0.011315321456922003 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0752552926281214 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 23.94229602804644 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 79.80765342682146 0.0 0.0 0.93 0.93 230.33593575149072 231.6677582243378 40.869 47.1875 0 0 0 58 0 0 0 0 0 55 0 0 -0 AcCa(16:1)+H AcCa(16:1)+H AcCa (16:1) (16:1) 398.3264854700001 C23 H44 O4 N1 1.1698414033E7 1420146.787 1.7409421934103766 0.1375620165631745 3.14437295421479 0.97 69.32384356682901 0.0 0.0 0.0 1.1698414033E7 0.0 0.0 0.0 0.0 0.0 1.1675677812E7 0.0 0.0 0.0 0.0 0.0 1358369.059 0.0 0.0 0.0 0.0 0.0 1420146.787 0.0 0.0 1.741 1.738 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -43 -42 -41 278 -40 -39 -38 -37 -36 273 -35 -34 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 398.32652 398.326256 1.7409421934103766 1.7409421934103766 1.7409421934103766 1.741 1.7409421934103766 1.7409421934103766 1.7409421934103766 1.7409421934103766 1.7409421934103766 1.738 1.7409421934103766 1.7409421934103766 593511.9375 440186.84375 1 1 1 1 1 1 1 1 1 1 1 1 398.3264854700001 398.3264854700001 398.3264854700001 3.452999993669437E-5 398.3264854700001 398.3264854700001 398.3264854700001 398.3264854700001 398.3264854700001 2.2947000007889073E-4 398.3264854700001 398.3264854700001 1000000.0 1000000.0 1000000.0 0.08668768258267122 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5760852176528775 1000000.0 1000000.0 0.0 0.0 0.0 13.832431630446504 0.0 0.0 0.0 0.0 0.0 10.50014577474882 0.0 0.0 B B 0.0 0.0 0.0 69.16215815223252 0.0 0.0 0.0 0.0 0.0 52.500728873744094 0.0 0.0 0.97 0.99 69.32384356682901 75.28035769927189 30.6654 24.7737 0 0 0 46 0 0 0 0 0 43 0 0 -0 AcCa(18:1)+H AcCa(18:1)+H AcCa (18:1) (18:1) 426.35778547000007 C25 H48 O4 N1 2.595530833E7 2596554.049 2.725 7.397760037437245 3.1367443843339013 0.99 103.79289507938549 0.0 0.0 0.0 2.3374844912E7 0.0 0.0 0.0 0.0 0.0 2.595530833E7 0.0 0.0 0.0 0.0 0.0 2483869.581 0.0 0.0 0.0 0.0 0.0 2596554.049 0.0 0.0 2.736 2.724 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -54 -53 -52 -51 -50 -49 -48 -47 -46 345 -45 -44 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 426.35779 426.357452 2.725 2.725 2.725 2.736 2.725 2.725 2.725 2.725 2.725 2.724 2.725 2.725 322680.8125 1 1 1 1 1 1 1 1 1 1 1 1 426.35778547000007 426.35778547000007 426.35778547000007 4.5299999555936665E-6 426.35778547000007 426.35778547000007 426.35778547000007 426.35778547000007 426.35778547000007 3.3347000004368965E-4 426.35778547000007 426.35778547000007 1000000.0 1000000.0 1000000.0 0.010624879174189285 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7821365327622326 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 13.709392793622788 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 68.54696396811394 0.0 0.0 0.99 0.99 58.464065524327964 103.79289507938549 10.5135 18.0076 0 0 0 61 0 0 0 0 0 58 0 0 -0 AcCa(18:2)+H AcCa(18:2)+H AcCa (18:2) (18:2) 424.34213547 C25 H46 O4 N1 2.8087971637E7 2664118.838 1.944 21.755064603447245 3.0516367234687305 0.99 133.57475785639517 0.0 0.0 0.0 2.0598462621E7 0.0 0.0 0.0 0.0 0.0 2.8087971637E7 0.0 0.0 0.0 0.0 0.0 2551572.919 0.0 0.0 0.0 0.0 0.0 2664118.838 0.0 0.0 1.938 1.946 0.0 0.0 0.0 0.06 0.0 0.0 0.0 0.0 0.0 0.092 0.0 0.0 0.0 0.0 0.0 0.066 0.0 0.0 0.0 0.0 0.0 0.073 0.0 0.0 0.85 0.76 -65 -64 -63 -62 -61 -60 -59 -58 -57 310 -56 -55 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 424.34214 424.342067 1.944 1.944 1.944 1.938 1.944 1.944 1.944 1.944 1.944 1.946 1.944 1.944 1486141.25 1 1 1 1 1 1 1 1 1 1 1 1 424.34213547 424.34213547 424.34213547 4.5299999555936665E-6 424.34213547 424.34213547 424.34213547 424.34213547 424.34213547 6.847000003062931E-5 424.34213547 424.34213547 1000000.0 1000000.0 1000000.0 0.010675347972635932 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.16135564750078885 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.48026995830554 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 57.4013497915277 0.0 0.0 0.89 0.99 155.35287474493518 133.57475785639517 28.0756 25.5064 0 0 0 48 0 0 0 0 0 45 0 0 -0 AcCa(18:3)+H AcCa(18:3)+H AcCa (18:3) (18:3) 422.3264854700001 C25 H44 O4 N1 1.12900777631E8 1.367798554E7 1.473 43.88957891722747 5.447835952869416 0.97 133.09354679343082 0.0 0.0 0.0 1.12900777631E8 0.0 0.0 0.0 0.0 0.0 5.942128290480001E7 0.0 0.0 0.0 0.0 0.0 1.2663267337E7 0.0 0.0 0.0 0.0 0.0 1.367798554E7 0.0 0.0 1.477 1.46 0.0 0.0 0.0 0.072 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.067 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 0.83 -76 -75 -74 246 -73 -72 -71 -70 -69 -68 -67 -66 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 422.326447 422.32649 1.473 1.473 1.473 1.477 1.473 1.473 1.473 1.473 1.473 1.46 1.473 1.473 8025660.0 1 1 1 1 1 1 1 1 1 1 1 1 422.3264854700001 422.3264854700001 422.3264854700001 3.8470000106372026E-5 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 422.3264854700001 4.529999898750248E-6 422.3264854700001 422.3264854700001 1000000.0 1000000.0 1000000.0 0.09109066428443248 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.01072629838431489 1000000.0 1000000.0 0.0 0.0 0.0 8.000073551354857 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 40.00036775677429 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.8152513598217821 133.09354679343082 1.3696999E7 20.9457 3.7515 0 0 0 37 0 0 0 0 0 22 0 0 -0 CL(64:3)+H CL(64:3)+H CL (64:3) (64:3) 1347.93255747 C73 H137 O17 P2 1465729.152 304754.625 9.796 0.15401692714087678 0.6869987179887438 0.89 66.42942033142832 1462540.079 0.0 0.0 0.0 0.0 0.0 1465729.152 0.0 0.0 0.0 0.0 0.0 301808.056 0.0 0.0 0.0 0.0 0.0 304754.625 0.0 0.0 0.0 0.0 0.0 9.81 9.795 0.038 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 1.0 -87 -86 -85 -84 -83 -82 1069 -81 -80 -79 -78 -77 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1347.93256 1347.935687 9.81 9.796 9.796 9.796 9.796 9.796 9.795 9.796 9.796 9.796 9.796 9.796 270361.71875 1 1 1 1 1 1 1 1 1 1 1 1 2.530000074330019E-6 1347.93255747 1347.93255747 1347.93255747 1347.93255747 1347.93255747 0.0031295300000238058 1347.93255747 1347.93255747 1347.93255747 1347.93255747 1347.93255747 0.0018769485611941142 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3217259518516062 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 8.986232038379352 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 29.95410679459784 0.0 0.0 0.0 0.0 0.0 0.94 0.89 352832.22 66.42942033142832 6.7356 5.7716 21 0 0 0 0 0 25 0 0 0 0 0 -0 CL(66:6)+H CL(66:6)+H CL (66:6) (66:6) 1369.9169074699998 C75 H135 O17 P2 2768636.684 442846.831 9.584 4.977226606536715 3.6984814734760536 0.96 34.40452834756406 2768636.684 0.0 0.0 0.0 0.0 0.0 2580381.69 0.0 0.0 0.0 0.0 0.0 442846.831 0.0 0.0 0.0 0.0 0.0 420274.303 0.0 0.0 0.0 0.0 0.0 9.582 9.584 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -98 -97 -96 -95 -94 -93 1017 -92 -91 -90 -89 -88 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1369.91691 1369.918284 9.582 9.584 9.584 9.584 9.584 9.584 9.584 9.584 9.584 9.584 9.584 9.584 294046.1875 1 1 1 1 1 1 1 1 1 1 1 1 2.530000074330019E-6 1369.9169074699998 1369.9169074699998 1369.9169074699998 1369.9169074699998 1369.9169074699998 0.0013765300002432923 1369.9169074699998 1369.9169074699998 1369.9169074699998 1369.9169074699998 1369.9169074699998 0.0018468273955407212 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.004827367804012 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 8.337478042511645 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 27.791593475038816 0.0 0.0 0.0 0.0 0.0 0.96 0.97 34.40452834756406 28.78782938878909 5.5644 5.8558 26 0 0 0 0 0 23 0 0 0 0 0 -0 CL(67:6)+H CL(67:6)+H CL (67:6) (67:6) 1383.93255747 C76 H137 O17 P2 1730782.7 320785.973 9.645010071220051 5.863931172219168 0.31623512125322306 0.98 16.337296159333995 1730782.7 0.0 0.0 0.0 0.0 0.0 1592965.939 0.0 0.0 0.0 0.0 0.0 320785.973 0.0 0.0 0.0 0.0 0.0 319354.542 0.0 0.0 0.0 0.0 0.0 9.65 9.642 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1036 -108 -107 -106 -105 -104 1022 -103 -102 -101 -100 -99 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1383.934525 1383.935678 9.65 9.645010071220051 9.645010071220051 9.645010071220051 9.645010071220051 9.645010071220051 9.642 9.645010071220051 9.645010071220051 9.645010071220051 9.645010071220051 9.645010071220051 289328.09375 317426.625 1 1 1 1 1 1 1 1 1 1 1 1 0.001967530000001716 1383.93255747 1383.93255747 1383.93255747 1383.93255747 1383.93255747 0.0031205300001602154 1383.93255747 1383.93255747 1383.93255747 1383.93255747 1383.93255747 1.4216950019577577 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.254828086323029 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 13.093168555320863 0.0 0.0 0.0 0.0 0.0 7.065141331309809 0.0 0.0 0.0 0.0 0.0 D D 43.64389518440287 0.0 0.0 0.0 0.0 0.0 23.55047110436603 0.0 0.0 0.0 0.0 0.0 0.98 0.8 16.337296159333995 18.971440953638744 7.8057 7.252 20 0 0 0 0 0 20 0 0 0 0 0 -0 CL(68:11)+H CL(68:11)+H CL (68:11) (68:11) 1387.86995747 C77 H129 O17 P2 3154325.24 829915.807 8.939 6.736630572847306 0.26762206089897816 0.93 58.29566325304101 3154325.24 0.0 0.0 0.0 0.0 0.0 2867475.718 0.0 0.0 0.0 0.0 0.0 826780.718 0.0 0.0 0.0 0.0 0.0 829915.807 0.0 0.0 0.0 0.0 0.0 8.941 8.936 0.027 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.89 0.85 815 -119 -118 -117 -116 -115 -114 -113 -112 -111 -110 -109 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1387.872309 1387.86996 8.941 8.939 8.939 8.939 8.939 8.939 8.936 8.939 8.939 8.939 8.939 8.939 917167.75 1 1 1 1 1 1 1 1 1 1 1 1 0.0023515300001690775 1387.86995747 1387.86995747 1387.86995747 1387.86995747 1387.86995747 2.530000074330019E-6 1387.86995747 1387.86995747 1387.86995747 1387.86995747 1387.86995747 1.694344623220874 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0018229374162274184 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.172522703487188 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 17.241742344957295 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.93 0.92 58.29566325304101 8.277128121851382 5.6648 6.0406 18 0 0 0 0 0 15 0 0 0 0 0 -0 CL(68:12)+H CL(68:12)+H CL (68:12) (68:12) 1385.8543074699999 C77 H127 O17 P2 3550390.542 947445.629 8.762357719478358 0.150871401614436 8.085380396639803 0.95 3.8127702037300324 3542823.346 0.0 0.0 0.0 0.0 0.0 3550390.542 0.0 0.0 0.0 0.0 0.0 844969.199 0.0 0.0 0.0 0.0 0.0 947445.629 0.0 0.0 0.0 0.0 0.0 8.765 8.76 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 773 -129 -128 -127 -126 -125 767 -124 -123 -122 -121 -120 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1385.857613 1385.857619 8.765 8.762357719478358 8.762357719478358 8.762357719478358 8.762357719478358 8.762357719478358 8.76 8.762357719478358 8.762357719478358 8.762357719478358 8.762357719478358 8.762357719478358 781548.1875 827398.0 1 1 1 1 1 1 1 1 1 1 1 1 0.003305530000034196 1385.8543074699999 1385.8543074699999 1385.8543074699999 1385.8543074699999 1385.8543074699999 0.003311530000246421 1385.8543074699999 1385.8543074699999 1385.8543074699999 1385.8543074699999 1385.8543074699999 2.38519300493335 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3895224645164275 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.607162021255352 0.0 0.0 0.0 0.0 0.0 7.401087164355359 0.0 0.0 0.0 0.0 0.0 D D 22.023873404184506 0.0 0.0 0.0 0.0 0.0 24.6702905478512 0.0 0.0 0.0 0.0 0.0 0.97 0.95 63.6782810645302 3.8127702037300324 9.3039 6.511 23 0 0 0 0 0 15 0 0 0 0 0 -0 CL(68:6)+H CL(68:6)+H CL (68:6) (68:6) 1397.9482074699997 C77 H139 O17 P2 1.2038150463E7 2696162.426 9.728619214911184 9.183909055889004 2.872453912982857 0.94 28.619124808425145 1.2038150463E7 0.0 0.0 0.0 0.0 0.0 1.0569977636E7 0.0 0.0 0.0 0.0 0.0 2696162.426 0.0 0.0 0.0 0.0 0.0 2588817.526 0.0 0.0 0.0 0.0 0.0 9.731 9.726 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 1.0 0.84 1061 -139 -138 -137 -136 -135 1053 -134 -133 -132 -131 -130 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1397.950441 1397.950867 9.731 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.726 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 1993532.5 1808147.5 1 1 1 1 1 1 1 1 1 1 1 1 0.0022335300002396252 1397.9482074699997 1397.9482074699997 1397.9482074699997 1397.9482074699997 1397.9482074699997 0.002659530000300947 1397.9482074699997 1397.9482074699997 1397.9482074699997 1397.9482074699997 1397.9482074699997 1.5977201360570128 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.902452455741656 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 14.420337191626427 0.0 0.0 0.0 0.0 0.0 15.215335100160978 0.0 0.0 0.0 0.0 0.0 D D 48.06779063875476 0.0 0.0 0.0 0.0 0.0 50.717783667203264 0.0 0.0 0.0 0.0 0.0 0.94 0.94 28.619124808425145 33.199467288453555 8.7177 8.0392 20 0 0 0 0 0 25 0 0 0 0 0 -0 CL(68:6)+Na CL(68:6)+Na CL (68:6) (68:6) 1419.9301524699997 C77 H138 O17 P2 Na1 5235098.212 983239.432 9.728619214911184 5.642423304081696 3.7009880287918415 0.99 8.142513924554693 5235098.212 0.0 0.0 0.0 0.0 0.0 4833386.244 0.0 0.0 0.0 0.0 0.0 933089.231 0.0 0.0 0.0 0.0 0.0 983239.432 0.0 0.0 0.0 0.0 0.0 9.731 9.722 0.046 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.85 0.83 1067 -149 -148 -147 -146 -145 1056 -144 -143 -142 -141 -140 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1419.931668 1419.931602 9.731 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.722 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 9.728619214911184 517624.34375 508777.90625 1 1 1 1 1 1 1 1 1 1 1 1 0.0015155300002334116 1419.9301524699997 1419.9301524699997 1419.9301524699997 1419.9301524699997 1419.9301524699997 0.0014495300004000455 1419.9301524699997 1419.9301524699997 1419.9301524699997 1419.9301524699997 1419.9301524699997 1.0673271481678968 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0208459887118786 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.395103121619748 0.0 0.0 0.0 0.0 0.0 7.115771001457622 0.0 0.0 0.0 0.0 0.0 D D 41.97551560809874 0.0 0.0 0.0 0.0 0.0 35.57885500728811 0.0 0.0 0.0 0.0 0.0 0.99 0.96 8.142513924554693 -0.44858838913562443 3.0645 4.4642 23 0 0 0 0 0 28 0 0 0 0 0 -0 CL(68:7)+H CL(68:7)+H CL (68:7) (68:7) 1395.93255747 C77 H137 O17 P2 3823436.493 775108.522 9.564765236854837 5.340899208852747 8.499250523374101 0.97 32.48122533509455 3823436.493 0.0 0.0 0.0 0.0 0.0 3545155.284 0.0 0.0 0.0 0.0 0.0 775108.522 0.0 0.0 0.0 0.0 0.0 687224.119 0.0 0.0 0.0 0.0 0.0 9.576 9.563 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1017 -159 -158 -157 -156 -155 1010 -154 -153 -152 -151 -150 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1395.933703 1395.933476 9.576 9.564765236854837 9.564765236854837 9.564765236854837 9.564765236854837 9.564765236854837 9.563 9.564765236854837 9.564765236854837 9.564765236854837 9.564765236854837 9.564765236854837 640576.0 629257.0 1 1 1 1 1 1 1 1 1 1 1 1 0.0011455300000307034 1395.93255747 1395.93255747 1395.93255747 1395.93255747 1395.93255747 9.185300000353891E-4 1395.93255747 1395.93255747 1395.93255747 1395.93255747 1395.93255747 0.8206198744349595 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6580045684299682 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.308900315346706 0.0 0.0 0.0 0.0 0.0 5.261048592623503 0.0 0.0 0.0 0.0 0.0 D D 31.029667717822356 0.0 0.0 0.0 0.0 0.0 17.53682864207834 0.0 0.0 0.0 0.0 0.0 0.97 0.87 32.48122533509455 688670.5 6.9693 6.0071 21 0 0 0 0 0 23 0 0 0 0 0 -0 CL(68:8)+H CL(68:8)+H CL (68:8) (68:8) 1393.9169074699998 C77 H135 O17 P2 6223464.53 1402764.385 9.416588611620067 0.9053666670659868 2.0148872242920013 0.99 18.452617413144324 6223464.53 0.0 0.0 0.0 0.0 0.0 6144287.307 0.0 0.0 0.0 0.0 0.0 1402764.385 0.0 0.0 0.0 0.0 0.0 1363354.373 0.0 0.0 0.0 0.0 0.0 9.416 9.41 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 968 -169 -168 -167 -166 -165 964 -164 -163 -162 -161 -160 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1393.91819 1393.918556 9.416 9.416588611620067 9.416588611620067 9.416588611620067 9.416588611620067 9.416588611620067 9.41 9.416588611620067 9.416588611620067 9.416588611620067 9.416588611620067 9.416588611620067 1293044.0 1197781.375 1 1 1 1 1 1 1 1 1 1 1 1 0.0012825300002532458 1393.9169074699998 1393.9169074699998 1393.9169074699998 1393.9169074699998 1393.9169074699998 0.0016485300002386793 1393.9169074699998 1393.9169074699998 1393.9169074699998 1393.9169074699998 1393.9169074699998 0.9200907122800279 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1826601653256432 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.239390322682183 0.0 0.0 0.0 0.0 0.0 11.129640718571812 0.0 0.0 0.0 0.0 0.0 D D 27.464634408940615 0.0 0.0 0.0 0.0 0.0 37.09880239523937 0.0 0.0 0.0 0.0 0.0 0.99 0.99 18.452617413144324 21.33193847659823 4.1471 6.4013 19 0 0 0 0 0 20 0 0 0 0 0 -0 CL(68:9)+Na CL(68:9)+Na CL (68:9) (68:9) 1413.8832024699998 C77 H132 O17 P2 Na1 7545315.228 1442035.258 9.253492849259015 6.257577301776028 4.652313220807431 0.87 21.255701598739975 6905882.207 0.0 0.0 0.0 0.0 0.0 7545315.228 0.0 0.0 0.0 0.0 0.0 1442035.258 0.0 0.0 0.0 0.0 0.0 1350180.241 0.0 0.0 0.0 0.0 0.0 9.257 9.253 0.035 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.87 0.89 909 -180 -179 -178 -177 -176 -175 -174 -173 -172 -171 -170 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1413.884531 1413.8832 9.257 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.253 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 1027329.3125 1 1 1 1 1 1 1 1 1 1 1 1 0.001328530000137107 1413.8832024699998 1413.8832024699998 1413.8832024699998 1413.8832024699998 1413.8832024699998 2.469999799359357E-6 1413.8832024699998 1413.8832024699998 1413.8832024699998 1413.8832024699998 1413.8832024699998 0.9396320699023908 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017469616974332546 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.058765617192032 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 45.29382808596016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 0.87 118.78213050731037 21.255701598739975 9.7214 5.4951 24 0 0 0 0 0 22 0 0 0 0 0 -0 CL(68:9)+H CL(68:9)+H CL (68:9) (68:9) 1391.9012574699998 C77 H133 O17 P2 1.3607168781E7 3116687.971 9.253492849259015 1.4763857139064889 4.3467239739924635 0.95 138.51028057785487 1.3325996674E7 0.0 0.0 0.0 0.0 0.0 1.3607168781E7 0.0 0.0 0.0 0.0 0.0 2930812.129 0.0 0.0 0.0 0.0 0.0 3116687.971 0.0 0.0 0.0 0.0 0.0 9.25 9.254 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 918 -190 -189 -188 -187 -186 913 -185 -184 -183 -182 -181 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1391.90194 1391.902728 9.25 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.254 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 9.253492849259015 2643660.25 2920688.25 1 1 1 1 1 1 1 1 1 1 1 1 6.825300001764845E-4 1391.9012574699998 1391.9012574699998 1391.9012574699998 1391.9012574699998 1391.9012574699998 0.0014705300002333388 1391.9012574699998 1391.9012574699998 1391.9012574699998 1391.9012574699998 1391.9012574699998 0.4903580598936238 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0564901729496667 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.715486788579963 0.0 0.0 0.0 0.0 0.0 8.15145845708488 0.0 0.0 0.0 0.0 0.0 D D 29.051622628599876 0.0 0.0 0.0 0.0 0.0 27.171528190282935 0.0 0.0 0.0 0.0 0.0 0.9 0.95 93.2786379206205 138.51028057785487 11.6109 11.5049 17 0 0 0 0 0 16 0 0 0 0 0 -0 CL(69:8)+H CL(69:8)+H CL (69:8) (69:8) 1407.93255747 C78 H137 O17 P2 3645071.117 785349.384 9.495487083334542 11.208279998747507 4.9396227115825875 0.99 19.066943099205798 3645071.117 0.0 0.0 0.0 0.0 0.0 3109723.216 0.0 0.0 0.0 0.0 0.0 785349.384 0.0 0.0 0.0 0.0 0.0 732338.948 0.0 0.0 0.0 0.0 0.0 9.499 9.483 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 990 -200 -199 -198 -197 -196 978 -195 -194 -193 -192 -191 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1407.933551 1407.933782 9.499 9.495487083334542 9.495487083334542 9.495487083334542 9.495487083334542 9.495487083334542 9.483 9.495487083334542 9.495487083334542 9.495487083334542 9.495487083334542 9.495487083334542 786053.5 690007.1875 1 1 1 1 1 1 1 1 1 1 1 1 9.935300001870928E-4 1407.93255747 1407.93255747 1407.93255747 1407.93255747 1407.93255747 0.001224530000172308 1407.93255747 1407.93255747 1407.93255747 1407.93255747 1407.93255747 0.7056659034665891 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8697362623482058 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.28341568700835 0.0 0.0 0.0 0.0 0.0 8.413667804587508 0.0 0.0 0.0 0.0 0.0 D D 24.278052290027837 0.0 0.0 0.0 0.0 0.0 28.045559348625027 0.0 0.0 0.0 0.0 0.0 0.99 0.97 19.066943099205798 50.68720215837893 5.2459 5.986 27 0 0 0 0 0 16 0 0 0 0 0 -0 CL(69:9)+H CL(69:9)+H CL (69:9) (69:9) 1405.9169074699998 C78 H135 O17 P2 7020757.718 1650439.94 9.340870339452 3.20783424053202 0.8202146523056484 0.95 1639768.0 7020757.718 0.0 0.0 0.0 0.0 0.0 6709320.906 0.0 0.0 0.0 0.0 0.0 1650439.94 0.0 0.0 0.0 0.0 0.0 1631405.912 0.0 0.0 0.0 0.0 0.0 9.342 9.339 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 942 -210 -209 -208 -207 -206 931 -205 -204 -203 -202 -201 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1405.917138 1405.917681 9.342 9.340870339452 9.340870339452 9.340870339452 9.340870339452 9.340870339452 9.339 9.340870339452 9.340870339452 9.340870339452 9.340870339452 9.340870339452 1486745.375 987923.4375 1 1 1 1 1 1 1 1 1 1 1 1 2.3053000018080638E-4 1405.9169074699998 1405.9169074699998 1405.9169074699998 1405.9169074699998 1405.9169074699998 7.735300000604184E-4 1405.9169074699998 1405.9169074699998 1405.9169074699998 1405.9169074699998 1405.9169074699998 0.1639712837621775 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5501961004597452 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 10.201011488845394 0.0 0.0 0.0 0.0 0.0 12.108535646099458 0.0 0.0 0.0 0.0 0.0 D D 34.00337162948465 0.0 0.0 0.0 0.0 0.0 40.361785486998194 0.0 0.0 0.0 0.0 0.0 0.95 0.96 1639768.0 64.24827027705132 8.0615 10.3397 20 0 0 0 0 0 20 0 0 0 0 0 -0 CL(70:10)+H CL(70:10)+H CL (70:10) (70:10) 1417.9169074699998 C79 H135 O17 P2 3.5360934185E7 8753247.869 9.256558050520866 1.1062234640979174 3.5309004098533174 0.94 649.3802099776294 3.481202856E7 0.0 0.0 0.0 0.0 0.0 3.5360934185E7 0.0 0.0 0.0 0.0 0.0 8326806.126 0.0 0.0 0.0 0.0 0.0 8753247.869 0.0 0.0 0.0 0.0 0.0 9.253 9.258 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 910 -220 -219 -218 -217 -216 904 -215 -214 -213 -212 -211 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1417.918096 1417.918336 9.253 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.258 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 7040705.0 6323111.5 1 1 1 1 1 1 1 1 1 1 1 1 0.0011885300002631993 1417.9169074699998 1417.9169074699998 1417.9169074699998 1417.9169074699998 1417.9169074699998 0.001428530000112005 1417.9169074699998 1417.9169074699998 1417.9169074699998 1417.9169074699998 1417.9169074699998 0.838222602468224 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0074849891316566 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.797660943770302 0.0 0.0 0.0 0.0 0.0 10.367670061835755 0.0 0.0 0.0 0.0 0.0 D D 32.65886981256767 0.0 0.0 0.0 0.0 0.0 34.55890020611918 0.0 0.0 0.0 0.0 0.0 0.82 0.94 24.83541860478451 649.3802099776294 7.3877 14.0275 15 0 0 0 0 0 16 0 0 0 0 0 -0 CL(70:10)+Na CL(70:10)+Na CL (70:10) (70:10) 1439.8988524699998 C79 H134 O17 P2 Na1 1.7097169662E7 4421580.325 9.256558050520866 4.364340607038743 8.855742992415552 0.86 53.99794307572955 1.6073504468E7 0.0 0.0 0.0 0.0 0.0 1.7097169662E7 0.0 0.0 0.0 0.0 0.0 3900457.956 0.0 0.0 0.0 0.0 0.0 4421580.325 0.0 0.0 0.0 0.0 0.0 9.257 9.255 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 913 -230 -229 -228 -227 -226 906 -225 -224 -223 -222 -221 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1439.89959 1439.9 9.257 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.255 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 9.256558050520866 3827228.25 3246234.5 1 1 1 1 1 1 1 1 1 1 1 1 7.375300001513097E-4 1439.8988524699998 1439.8988524699998 1439.8988524699998 1439.8988524699998 1439.8988524699998 0.0011475300002530275 1439.8988524699998 1439.8988524699998 1439.8988524699998 1439.8988524699998 1439.8988524699998 0.5122095895042572 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7969518124724919 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.279410736773311 0.0 0.0 0.0 0.0 0.0 6.161267259673493 0.0 0.0 0.0 0.0 0.0 D D 31.397053683866556 0.0 0.0 0.0 0.0 0.0 30.80633629836747 0.0 0.0 0.0 0.0 0.0 0.89 0.86 31.34308305489288 53.99794307572955 11.3019 13.7778 16 0 0 0 0 0 15 0 0 0 0 0 -0 CL(70:11)+H CL(70:11)+H CL (70:11) (70:11) 1415.9012574699998 C79 H133 O17 P2 3.1000786389E7 9132523.014 9.110974073727347 1.7640721870410738 0.3910338266242008 0.97 175.78519795169981 3.1000786389E7 0.0 0.0 0.0 0.0 0.0 3.0236915014E7 0.0 0.0 0.0 0.0 0.0 9082158.932 0.0 0.0 0.0 0.0 0.0 9132523.014 0.0 0.0 0.0 0.0 0.0 9.115 9.108 0.028 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.87 0.9 859 -240 -239 -238 -237 -236 851 -235 -234 -233 -232 -231 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1415.903884 1415.903455 9.115 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.108 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 2802479.75 3565741.25 1 1 1 1 1 1 1 1 1 1 1 1 0.002626530000270577 1415.9012574699998 1415.9012574699998 1415.9012574699998 1415.9012574699998 1415.9012574699998 0.002197530000103143 1415.9012574699998 1415.9012574699998 1415.9012574699998 1415.9012574699998 1415.9012574699998 1.8550234251248472 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5520361949743549 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.419544082907782 0.0 0.0 0.0 0.0 0.0 7.010719775409387 0.0 0.0 0.0 0.0 0.0 D D 24.73181360969261 0.0 0.0 0.0 0.0 0.0 23.369065918031293 0.0 0.0 0.0 0.0 0.0 0.97 0.95 175.78519795169981 1.0520435E7 7.0381 8.2109 14 0 0 0 0 0 15 0 0 0 0 0 -0 CL(70:11)+Na CL(70:11)+Na CL (70:11) (70:11) 1437.8832024699998 C79 H132 O17 P2 Na1 1.6569928783E7 4751616.553 9.110974073727347 7.297538332079292 2.0379502939584033 0.98 22.74001077931289 1.4943777771E7 0.0 0.0 0.0 0.0 0.0 1.6569928783E7 0.0 0.0 0.0 0.0 0.0 4616615.784 0.0 0.0 0.0 0.0 0.0 4751616.553 0.0 0.0 0.0 0.0 0.0 9.112 9.108 0.026 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.9 0.95 861 -250 -249 -248 -247 -246 852 -245 -244 -243 -242 -241 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1437.884524 1437.884633 9.112 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.108 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 9.110974073727347 3373174.0 2194907.75 1 1 1 1 1 1 1 1 1 1 1 1 0.0013215300002684671 1437.8832024699998 1437.8832024699998 1437.8832024699998 1437.8832024699998 1437.8832024699998 0.0014305300001069554 1437.8832024699998 1437.8832024699998 1437.8832024699998 1437.8832024699998 1437.8832024699998 0.9190802131900138 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9948860920341701 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.0160513090406615 0.0 0.0 0.0 0.0 0.0 6.164633351473097 0.0 0.0 0.0 0.0 0.0 D D 30.08025654520331 0.0 0.0 0.0 0.0 0.0 30.823166757365488 0.0 0.0 0.0 0.0 0.0 0.97 0.98 23.401155967570052 22.74001077931289 9.2152 8.5078 14 0 0 0 0 0 14 0 0 0 0 0 -0 CL(70:12)+H CL(70:12)+H CL (70:12) (70:12) 1413.8856074699997 C79 H131 O17 P2 2.6213570131E7 7226860.955 8.948941600880797 0.9870076594732549 1.6006590481336347 0.89 95.12934606335969 2.6213570131E7 0.0 0.0 0.0 0.0 0.0 2.5850206719E7 0.0 0.0 0.0 0.0 0.0 7226860.955 0.0 0.0 0.0 0.0 0.0 7065099.28 0.0 0.0 0.0 0.0 0.0 8.947 8.945 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.89 0.9 812 -260 -259 -258 -257 -256 803 -255 -254 -253 -252 -251 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1413.888305 1413.888485 8.947 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.945 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 2847103.5 1238902.625 1 1 1 1 1 1 1 1 1 1 1 1 0.0026975300002050062 1413.8856074699997 1413.8856074699997 1413.8856074699997 1413.8856074699997 1413.8856074699997 0.0028775300002052973 1413.8856074699997 1413.8856074699997 1413.8856074699997 1413.8856074699997 1413.8856074699997 1.9078841922947034 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.035192935696075 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 10.741110310510873 0.0 0.0 0.0 0.0 0.0 12.2238612253074 0.0 0.0 0.0 0.0 0.0 D D 35.80370103503625 0.0 0.0 0.0 0.0 0.0 40.746204084358006 0.0 0.0 0.0 0.0 0.0 0.89 0.91 95.12934606335969 185.9735364867103 9.0239 9.7055 17 0 0 0 0 0 15 0 0 0 0 0 -0 CL(70:12)+Na CL(70:12)+Na CL (70:12) (70:12) 1435.8675524699997 C79 H130 O17 P2 Na1 1.9449629242E7 5252130.9 8.948941600880797 1.4910967840188967 2.7197807549749995 0.95 19.274646023941816 1.9043768465E7 0.0 0.0 0.0 0.0 0.0 1.9449629242E7 0.0 0.0 0.0 0.0 0.0 5053927.322 0.0 0.0 0.0 0.0 0.0 5252130.9 0.0 0.0 0.0 0.0 0.0 8.952 8.944 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -271 -270 -269 -268 -267 -266 804 -265 -264 -263 -262 -261 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1435.86755 1435.869541 8.952 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.944 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 8.948941600880797 2955252.75 1 1 1 1 1 1 1 1 1 1 1 1 2.469999799359357E-6 1435.8675524699997 1435.8675524699997 1435.8675524699997 1435.8675524699997 1435.8675524699997 0.0019885300002897566 1435.8675524699997 1435.8675524699997 1435.8675524699997 1435.8675524699997 1435.8675524699997 0.0017202142322322335 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.3848979293870518 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.346759054793492 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 31.733795273967463 0.0 0.0 0.0 0.0 0.0 0.96 0.95 100.76689836428186 19.274646023941816 15.8635 14.7733 18 0 0 0 0 0 16 0 0 0 0 0 -0 CL(70:7)+H CL(70:7)+H CL (70:7) (70:7) 1423.9638574699998 C79 H141 O17 P2 8390731.56 1679132.996 9.723529852829317 17.771959450881614 8.57266998299255 0.99 1.6882707071581498 6517289.319 0.0 0.0 0.0 0.0 0.0 8390731.56 0.0 0.0 0.0 0.0 0.0 1487196.645 0.0 0.0 0.0 0.0 0.0 1679132.996 0.0 0.0 0.0 0.0 0.0 9.727 9.721 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1052 -281 -280 -279 -278 -277 1047 -276 -275 -274 -273 -272 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1423.963767 1423.963776 9.727 9.723529852829317 9.723529852829317 9.723529852829317 9.723529852829317 9.723529852829317 9.721 9.723529852829317 9.723529852829317 9.723529852829317 9.723529852829317 9.723529852829317 1132399.5 1489894.625 1 1 1 1 1 1 1 1 1 1 1 1 9.046999980455439E-5 1423.9638574699998 1423.9638574699998 1423.9638574699998 1423.9638574699998 1423.9638574699998 8.146999971359037E-5 1423.9638574699998 1423.9638574699998 1423.9638574699998 1423.9638574699998 1423.9638574699998 0.06353391578722736 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.05721353058661237 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.708062233712656 0.0 0.0 0.0 0.0 0.0 11.197148213913431 0.0 0.0 0.0 0.0 0.0 D D 32.36020744570885 0.0 0.0 0.0 0.0 0.0 37.32382737971144 0.0 0.0 0.0 0.0 0.0 0.98 0.99 58.98798558874244 1.6882707071581498 6.7501 4.8651 20 0 0 0 0 0 21 0 0 0 0 0 -0 CL(70:8)+H CL(70:8)+H CL (70:8) (70:8) 1421.9482074699997 C79 H139 O17 P2 1.8494243203E7 3614002.224 9.58325982307147 3.6300683564887386 1.110522885836767 0.99 13.237237425156195 1.8494243203E7 0.0 0.0 0.0 0.0 0.0 1.7568566434E7 0.0 0.0 0.0 0.0 0.0 3557685.95 0.0 0.0 0.0 0.0 0.0 3614002.224 0.0 0.0 0.0 0.0 0.0 9.578 9.587 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1007 -291 -290 -289 -288 -287 1003 -286 -285 -284 -283 -282 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1421.949111 1421.948594 9.578 9.58325982307147 9.58325982307147 9.58325982307147 9.58325982307147 9.58325982307147 9.587 9.58325982307147 9.58325982307147 9.58325982307147 9.58325982307147 9.58325982307147 2449472.25 2916377.5 1 1 1 1 1 1 1 1 1 1 1 1 9.035300001869473E-4 1421.9482074699997 1421.9482074699997 1421.9482074699997 1421.9482074699997 1421.9482074699997 3.865300002416916E-4 1421.9482074699997 1421.9482074699997 1421.9482074699997 1421.9482074699997 1421.9482074699997 0.6354169550201497 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2718312792344419 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.225434771095028 0.0 0.0 0.0 0.0 0.0 10.92915115606275 0.0 0.0 0.0 0.0 0.0 D D 30.751449236983426 0.0 0.0 0.0 0.0 0.0 36.4305038535425 0.0 0.0 0.0 0.0 0.0 0.99 0.97 13.237237425156195 10.928726134341776 5.2742 9.9442 26 0 0 0 0 0 25 0 0 0 0 0 -0 CL(70:9)+H CL(70:9)+H CL (70:9) (70:9) 1419.93255747 C79 H137 O17 P2 4.3742488639E7 1.1115571451E7 9.43005537978439 1.6451348356263293 6.766721147548371 0.96 115.72351943183466 4.3742488639E7 0.0 0.0 0.0 0.0 0.0 4.273649078E7 0.0 0.0 0.0 0.0 0.0 1.1115571451E7 0.0 0.0 0.0 0.0 0.0 1.0100429427E7 0.0 0.0 0.0 0.0 0.0 9.426 9.424 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 962 -301 -300 -299 -298 -297 956 -296 -295 -294 -293 -292 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1419.932876 1419.933051 9.426 9.43005537978439 9.43005537978439 9.43005537978439 9.43005537978439 9.43005537978439 9.424 9.43005537978439 9.43005537978439 9.43005537978439 9.43005537978439 9.43005537978439 5409431.0 5399671.5 1 1 1 1 1 1 1 1 1 1 1 1 3.185300001860014E-4 1419.93255747 1419.93255747 1419.93255747 1419.93255747 1419.93255747 4.935300000852294E-4 1419.93255747 1419.93255747 1419.93255747 1419.93255747 1419.93255747 0.22432755591825443 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.34757284596994437 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.405778113887333 0.0 0.0 0.0 0.0 0.0 9.562521365383871 0.0 0.0 0.0 0.0 0.0 D D 28.019260379624445 0.0 0.0 0.0 0.0 0.0 31.87507121794624 0.0 0.0 0.0 0.0 0.0 0.96 0.96 115.72351943183466 128.06815835131954 9.4374 10.5603 18 0 0 0 0 0 18 0 0 0 0 0 -0 CL(70:9)+H CL(70:9)+H CL (70:9) (70:9) 1419.93255747 C79 H137 O17 P2 5235098.212 983239.432 9.725 5.642423304081696 3.7009880287918415 0.99 8.142513924554693 5235098.212 0.0 0.0 0.0 0.0 0.0 4833386.244 0.0 0.0 0.0 0.0 0.0 933089.231 0.0 0.0 0.0 0.0 0.0 983239.432 0.0 0.0 0.0 0.0 0.0 9.731 9.722 0.046 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.85 0.83 -312 -311 -310 -309 -308 -307 1016 -306 -305 -304 -303 -302 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1419.93015 1419.932129 9.731 9.725 9.725 9.725 9.725 9.725 9.722 9.725 9.725 9.725 9.725 9.725 309870.3125 1 1 1 1 1 1 1 1 1 1 1 1 0.002407469999980094 1419.93255747 1419.93255747 1419.93255747 1419.93255747 1419.93255747 4.2846999986068113E-4 1419.93255747 1419.93255747 1419.93255747 1419.93255747 1419.93255747 1.6954819349094041 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.30175376823820294 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 10.12807203222711 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 33.7602401074237 0.0 0.0 0.0 0.0 0.0 0.99 0.96 8.142513924554693 -0.44858838913562443 3.0645 4.4642 23 0 0 0 0 0 28 0 0 0 0 0 -0 CL(71:10)+H CL(71:10)+H CL (71:10) (71:10) 1431.93255747 C80 H137 O17 P2 9588044.924 1651059.905 9.342481795569881 11.130002366831885 3.1517343163668636 0.8 6.457132185298176 9588044.924 0.0 0.0 0.0 0.0 0.0 8188975.605 0.0 0.0 0.0 0.0 0.0 1651059.905 0.0 0.0 0.0 0.0 0.0 1579072.758 0.0 0.0 0.0 0.0 0.0 9.342 9.342 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 940 -322 -321 -320 -319 -318 936 -317 -316 -315 -314 -313 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1431.93335 1431.933339 9.342 9.342481795569881 9.342481795569881 9.342481795569881 9.342481795569881 9.342481795569881 9.342 9.342481795569881 9.342481795569881 9.342481795569881 9.342481795569881 9.342481795569881 1168562.25 1576186.0 1 1 1 1 1 1 1 1 1 1 1 1 7.925300001261348E-4 1431.93255747 1431.93255747 1431.93255747 1431.93255747 1431.93255747 7.815300000402203E-4 1431.93255747 1431.93255747 1431.93255747 1431.93255747 1431.93255747 0.5534688040939658 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5457868779944924 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.967272751410971 0.0 0.0 0.0 0.0 0.0 10.947608188521109 0.0 0.0 0.0 0.0 0.0 D D 26.557575838036573 0.0 0.0 0.0 0.0 0.0 36.49202729507036 0.0 0.0 0.0 0.0 0.0 0.8 0.88 6.457132185298176 7.340102031467265 12.6864 4.3746 26 0 0 0 0 0 17 0 0 0 0 0 -0 CL(71:9)+Na CL(71:9)+Na CL (71:9) (71:9) 1455.9301524699997 C80 H138 O17 P2 Na1 2379497.649 411694.877 9.50394205248748 11.101812230265592 3.4989325326567755 0.93 9.699099139627469 2033101.277 0.0 0.0 0.0 0.0 0.0 2379497.649 0.0 0.0 0.0 0.0 0.0 411694.877 0.0 0.0 0.0 0.0 0.0 391815.085 0.0 0.0 0.0 0.0 0.0 9.499 9.508 0.03 0.0 0.0 0.0 0.0 0.0 0.057 0.0 0.0 0.0 0.0 0.0 0.048 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.84 0.86 -333 -332 -331 -330 -329 -328 993 -327 -326 -325 -324 -323 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1455.93015 1455.928444 9.499 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.508 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 312672.5 1 1 1 1 1 1 1 1 1 1 1 1 2.469999799359357E-6 1455.9301524699997 1455.9301524699997 1455.9301524699997 1455.9301524699997 1455.9301524699997 0.0017084699998122233 1455.9301524699997 1455.9301524699997 1455.9301524699997 1455.9301524699997 1455.9301524699997 0.001696509818942192 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1734560184180451 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.046570003450869 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 35.23285001725434 0.0 0.0 0.0 0.0 0.0 0.9 0.93 26.64970661700587 9.699099139627469 3.6685 5.201 21 0 0 0 0 0 24 0 0 0 0 0 -0 CL(71:9)+H CL(71:9)+H CL (71:9) (71:9) 1433.9482074699997 C80 H139 O17 P2 5529463.615 941724.82 9.50394205248748 5.7568456958709175 0.3880730274471196 0.95 16.936979320013794 5529463.615 0.0 0.0 0.0 0.0 0.0 5096895.906 0.0 0.0 0.0 0.0 0.0 941724.82 0.0 0.0 0.0 0.0 0.0 936570.607 0.0 0.0 0.0 0.0 0.0 9.514 9.503 0.046 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.046 0.0 0.0 0.0 0.0 0.0 0.043 0.0 0.0 0.0 0.0 0.0 0.85 0.84 -344 -343 -342 -341 -340 -339 984 -338 -337 -336 -335 -334 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1433.94821 1433.950042 9.514 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.503 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 9.50394205248748 937823.0625 1 1 1 1 1 1 1 1 1 1 1 1 2.5300003017036943E-6 1433.9482074699997 1433.9482074699997 1433.9482074699997 1433.9482074699997 1433.9482074699997 0.0018345300002238218 1433.9482074699997 1433.9482074699997 1433.9482074699997 1433.9482074699997 1433.9482074699997 0.001764359611123978 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2793558307524877 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 6.080743609424942 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 20.269145364749807 0.0 0.0 0.0 0.0 0.0 0.95 0.99 16.936979320013794 7.850062913248032 3.7051 3.4119 28 0 0 0 0 0 27 0 0 0 0 0 -0 CL(72:10)+H CL(72:10)+H CL (72:10) (72:10) 1445.9482074699997 C81 H139 O17 P2 8.9531022978E7 2.1289803902E7 9.42905533539482 7.608181551527217 3.4373765884658307 0.92 24.605008917484522 8.0389636815E7 0.0 0.0 0.0 0.0 0.0 8.9531022978E7 0.0 0.0 0.0 0.0 0.0 2.1289803902E7 0.0 0.0 0.0 0.0 0.0 2.0279425417E7 0.0 0.0 0.0 0.0 0.0 9.429 9.425 0.027 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.91 0.9 -355 -354 -353 -352 -351 -350 955 -349 -348 -347 -346 -345 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1445.94821 1445.948852 9.429 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.425 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 1.1184897E7 1 1 1 1 1 1 1 1 1 1 1 1 2.5300003017036943E-6 1445.9482074699997 1445.9482074699997 1445.9482074699997 1445.9482074699997 1445.9482074699997 6.445300002724252E-4 1445.9482074699997 1445.9482074699997 1445.9482074699997 1445.9482074699997 1445.9482074699997 0.0017497170981874096 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4457490226431903 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.124805207291444 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 23.74935069097148 0.0 0.0 0.0 0.0 0.0 0.94 0.92 78.97025479765291 24.605008917484522 7.7265 6.5487 25 0 0 0 0 0 21 0 0 0 0 0 -0 CL(72:10)+Na CL(72:10)+Na CL (72:10) (72:10) 1467.9301524699997 C81 H138 O17 P2 Na1 3.6069828206E7 8454815.311 9.42905533539482 1.7137215034014108 0.5290574830940775 0.92 54.53887816902514 3.520611763E7 0.0 0.0 0.0 0.0 0.0 3.6069828206E7 0.0 0.0 0.0 0.0 0.0 8454815.311 0.0 0.0 0.0 0.0 0.0 8391792.13 0.0 0.0 0.0 0.0 0.0 9.431 9.427 0.03 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.86 0.87 963 -365 -364 -363 -362 -361 957 -360 -359 -358 -357 -356 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1467.928576 1467.928102 9.431 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.427 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 9.42905533539482 4068742.5 4192637.25 1 1 1 1 1 1 1 1 1 1 1 1 0.0015764699996907439 1467.9301524699997 1467.9301524699997 1467.9301524699997 1467.9301524699997 1467.9301524699997 0.0020504699996308773 1467.9301524699997 1467.9301524699997 1467.9301524699997 1467.9301524699997 1467.9301524699997 1.07394074373233 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.3968443908456216 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.8182414882155165 0.0 0.0 0.0 0.0 0.0 6.487932463159968 0.0 0.0 0.0 0.0 0.0 D D 34.09120744107758 0.0 0.0 0.0 0.0 0.0 32.43966231579984 0.0 0.0 0.0 0.0 0.0 0.94 0.92 29.92114121680775 54.53887816902514 7.5156 10.7661 20 0 0 0 0 0 20 0 0 0 0 0 -0 CL(72:11)+H CL(72:11)+H CL (72:11) (72:11) 1443.93255747 C81 H137 O17 P2 2.0070352153E8 5.462476338E7 9.2713139774139 1.0730496479227674 8.507324029608771 0.87 111.23981294257776 2.0070352153E8 0.0 0.0 0.0 0.0 0.0 1.976807384E8 0.0 0.0 0.0 0.0 0.0 4.8425675103E7 0.0 0.0 0.0 0.0 0.0 5.462476338E7 0.0 0.0 0.0 0.0 0.0 9.273 9.268 0.026 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.91 0.9 936 -376 -375 -374 -373 -372 -371 -370 -369 -368 -367 -366 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1443.93359 1443.93256 9.273 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.268 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 2.2503578E7 1 1 1 1 1 1 1 1 1 1 1 1 0.0010325300002023141 1443.93255747 1443.93255747 1443.93255747 1443.93255747 1443.93255747 2.530000074330019E-6 1443.93255747 1443.93255747 1443.93255747 1443.93255747 1443.93255747 0.715081874745917 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017521594490278564 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.788913580764536 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 42.62971193588179 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 0.88 111.23981294257776 191.94024215381145 10.6192 11.1261 18 0 0 0 0 0 16 0 0 0 0 0 -0 CL(72:11)+Na CL(72:11)+Na CL (72:11) (72:11) 1465.91450247 C81 H136 O17 P2 Na1 1.0277912026979923E8 2.685208962E7 9.2713139774139 2.3736383711627007 6.638098188902304 0.5804066619051105 40.047718209062445 9.9385949815E7 0.0 0.0 0.0 0.0 0.0 1.0277912026979923E8 0.0 0.0 0.0 0.0 0.0 2.4444316227E7 0.0 0.0 0.0 0.0 0.0 2.685208962E7 0.0 0.0 0.0 0.0 0.0 9.275 9.261 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 0.93 976 -386 -385 -384 -383 -382 905 -381 -380 -379 -378 -377 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1465.909581 1465.914273 9.275 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.261 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 9.2713139774139 1043575.375 1.0200263E7 1 1 1 1 1 1 1 1 1 1 1 1 0.004921469999999317 1465.91450247 1465.91450247 1465.91450247 1465.91450247 1465.91450247 2.2946999979467364E-4 1465.91450247 1465.91450247 1465.91450247 1465.91450247 1465.91450247 3.357269466743703 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.15653709640502703 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.70464229873012 0.0 0.0 0.0 0.0 0.0 6.799513246476612 0.0 0.0 0.0 0.0 0.0 D D 28.523211493650606 0.0 0.0 0.0 0.0 0.0 33.99756623238306 0.0 0.0 0.0 0.0 0.0 0.92 0.5804066619051105 33.304479811911854 40.047718209062445 9.6206 8.5818 15 0 0 0 0 0 19 0 0 0 0 0 -0 CL(72:11)+H CL(72:11)+H CL (72:11) (72:11) 1443.93255747 C81 H137 O17 P2 9263742.524 3648085.642 9.423 2.6948872531379644 3.823507207324814 0.85 1.8028730381866114 8917289.674 0.0 0.0 0.0 0.0 0.0 9263742.524 0.0 0.0 0.0 0.0 0.0 3648085.642 0.0 0.0 0.0 0.0 0.0 3456017.139 0.0 0.0 0.0 0.0 0.0 9.431 9.432 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 988 -397 -396 -395 -394 -393 -392 -391 -390 -389 -388 -387 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1443.92981 1443.93256 9.431 9.423 9.423 9.423 9.423 9.423 9.432 9.423 9.423 9.423 9.423 9.423 1223522.875 1 1 1 1 1 1 1 1 1 1 1 1 0.0027474699998037977 1443.93255747 1443.93255747 1443.93255747 1443.93255747 1443.93255747 2.530000074330019E-6 1443.93255747 1443.93255747 1443.93255747 1443.93255747 1443.93255747 1.9027689247604496 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017521594490278564 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.319412919612857 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 31.064709732042857 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 0.85 14.049872598200022 1.8028730381866114 10.6267 11.2347 12 0 0 0 0 0 11 0 0 0 0 0 -0 CL(72:12)+H CL(72:12)+H CL (72:12) (72:12) 1441.9169074699998 C81 H135 O17 P2 2.95224514654E8 7.8221032186E7 9.114937825540352 7.778814699231186 0.023210505711291223 0.93 278.56015785584975 2.64440410591E8 0.0 0.0 0.0 0.0 0.0 2.95224514654E8 0.0 0.0 0.0 0.0 0.0 7.8221032186E7 0.0 0.0 0.0 0.0 0.0 7.8195360649E7 0.0 0.0 0.0 0.0 0.0 9.115 9.109 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 857 -407 -406 -405 -404 -403 847 -402 -401 -400 -399 -398 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1441.919495 1441.921395 9.115 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.109 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 2299665.5 447058.0 1 1 1 1 1 1 1 1 1 1 1 1 0.002587530000255356 1441.9169074699998 1441.9169074699998 1441.9169074699998 1441.9169074699998 1441.9169074699998 0.004487530000233164 1441.9169074699998 1441.9169074699998 1441.9169074699998 1441.9169074699998 1441.9169074699998 1.7945070113613266 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.1121973651775985 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 11.296882088441237 0.0 0.0 0.0 0.0 0.0 10.597187072185479 0.0 0.0 0.0 0.0 0.0 D D 37.656273628137455 0.0 0.0 0.0 0.0 0.0 35.32395690728493 0.0 0.0 0.0 0.0 0.0 0.95 0.93 274.1713487148845 278.56015785584975 14.5243 14.6064 14 0 0 0 0 0 19 0 0 0 0 0 -0 CL(72:12)+Na CL(72:12)+Na CL (72:12) (72:12) 1463.8988524699998 C81 H134 O17 P2 Na1 1.46366099783E8 4.3283066244E7 9.114937825540352 3.756247303360019 2.907724570763244 0.97 2916.722153491311 1.3879210415E8 0.0 0.0 0.0 0.0 0.0 1.46366099783E8 0.0 0.0 0.0 0.0 0.0 4.1539062409E7 0.0 0.0 0.0 0.0 0.0 4.3283066244E7 0.0 0.0 0.0 0.0 0.0 9.114 9.11 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 858 -417 -416 -415 -414 -413 850 -412 -411 -410 -409 -408 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1463.900032 1463.899883 9.114 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.11 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 9.114937825540352 7694668.0 2673293.25 1 1 1 1 1 1 1 1 1 1 1 1 0.0011795300001722353 1463.8988524699998 1463.8988524699998 1463.8988524699998 1463.8988524699998 1463.8988524699998 0.0010305300002073636 1463.8988524699998 1463.8988524699998 1463.8988524699998 1463.8988524699998 1463.8988524699998 0.805745559662161 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7039625712313226 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.154416110216408 0.0 0.0 0.0 0.0 0.0 8.06131090979146 0.0 0.0 0.0 0.0 0.0 D D 40.77208055108204 0.0 0.0 0.0 0.0 0.0 40.3065545489573 0.0 0.0 0.0 0.0 0.0 0.95 0.97 153.11138549969735 2916.722153491311 23.4977 24.0272 12 0 0 0 0 0 13 0 0 0 0 0 -0 CL(72:8)+H CL(72:8)+H CL (72:8) (72:8) 1449.9795074699998 C81 H143 O17 P2 7039018.628 1167603.546 9.72 1.7778399765201272 0.6698753087946027 0.98 19.761424913251968 6864237.637 0.0 0.0 0.0 0.0 0.0 7039018.628 0.0 0.0 0.0 0.0 0.0 1156594.439 0.0 0.0 0.0 0.0 0.0 1167603.546 0.0 0.0 0.0 0.0 0.0 9.7 9.726 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -428 -427 -426 -425 -424 -423 1044 -422 -421 -420 -419 -418 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1449.97951 1449.978703 9.7 9.72 9.72 9.72 9.72 9.72 9.726 9.72 9.72 9.72 9.72 9.72 1124608.375 1 1 1 1 1 1 1 1 1 1 1 1 2.530000074330019E-6 1449.9795074699998 1449.9795074699998 1449.9795074699998 1449.9795074699998 1449.9795074699998 8.044699998208671E-4 1449.9795074699998 1449.9795074699998 1449.9795074699998 1449.9795074699998 1449.9795074699998 0.0017448522970814227 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5548147375024275 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 7.909387352498005 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 0.0 0.0 0.0 0.0 26.364624508326685 0.0 0.0 0.0 0.0 0.0 0.59 0.98 26.02464416020626 19.761424913251968 4.9845 4.1227 21 0 0 0 0 0 16 0 0 0 0 0 -0 CL(72:9)+H CL(72:9)+H CL (72:9) (72:9) 1447.9638574699998 C81 H141 O17 P2 2.4578824265E7 5146866.064 9.584235655816213 3.066111890734218 0.5102028247639459 0.99 24.34124084105404 2.4578824265E7 0.0 0.0 0.0 0.0 0.0 2.3535669086E7 0.0 0.0 0.0 0.0 0.0 5109863.08 0.0 0.0 0.0 0.0 0.0 5146866.064 0.0 0.0 0.0 0.0 0.0 9.586 9.585 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1027 -438 -437 -436 -435 -434 1002 -433 -432 -431 -430 -429 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1447.963933 1447.962418 9.586 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.585 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 2085316.0 4217363.0 1 1 1 1 1 1 1 1 1 1 1 1 7.553000023108325E-5 1447.9638574699998 1447.9638574699998 1447.9638574699998 1447.9638574699998 1447.9638574699998 0.001439469999695575 1447.9638574699998 1447.9638574699998 1447.9638574699998 1447.9638574699998 1447.9638574699998 0.052162904371836606 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9941339297036973 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.818904218512435 0.0 0.0 0.0 0.0 0.0 10.447257380868587 0.0 0.0 0.0 0.0 0.0 D D 32.72968072837478 0.0 0.0 0.0 0.0 0.0 34.82419126956196 0.0 0.0 0.0 0.0 0.0 0.99 0.97 24.34124084105404 28.38397669974552 6.3057 6.6963 21 0 0 0 0 0 22 0 0 0 0 0 -0 CL(72:9)+Na CL(72:9)+Na CL (72:9) (72:9) 1469.9458024699998 C81 H140 O17 P2 Na1 9975126.997 1758632.913 9.584235655816213 4.61864554975648 7.377961568651521 0.99 84.24692490331182 9975126.997 0.0 0.0 0.0 0.0 0.0 9344182.388 0.0 0.0 0.0 0.0 0.0 1584235.258 0.0 0.0 0.0 0.0 0.0 1758632.913 0.0 0.0 0.0 0.0 0.0 9.591 9.588 0.049 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.049 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 1011 -449 -448 -447 -446 -445 -444 -443 -442 -441 -440 -439 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1469.944806 1469.9458 9.591 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.588 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 9.584235655816213 1330404.0 1 1 1 1 1 1 1 1 1 1 1 1 9.96469999790861E-4 1469.9458024699998 1469.9458024699998 1469.9458024699998 1469.9458024699998 1469.9458024699998 2.469999799359357E-6 1469.9458024699998 1469.9458024699998 1469.9458024699998 1469.9458024699998 1469.9458024699998 0.6778957415412588 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0016803339246990825 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.097411770150684 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 30.487058850753417 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.97 84.24692490331182 38.13949695942606 5.1715 6.8329 25 0 0 0 0 0 22 0 0 0 0 0 -0 CL(73:11)+H CL(73:11)+H CL (73:11) (73:11) 1457.9482074699997 C82 H139 O17 P2 757209.555 197376.17 9.503 6.170922037437922 11.59014870538266 0.92 9.177681877882348 693890.78 0.0 0.0 0.0 0.0 0.0 757209.555 0.0 0.0 0.0 0.0 0.0 167474.9 0.0 0.0 0.0 0.0 0.0 197376.17 0.0 0.0 0.0 0.0 0.0 9.511 9.518 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 983 -460 -459 -458 -457 -456 -455 -454 -453 -452 -451 -450 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1457.942149 1457.94821 9.511 9.503 9.503 9.503 9.503 9.503 9.518 9.503 9.503 9.503 9.503 9.503 79233.546875 1 1 1 1 1 1 1 1 1 1 1 1 0.0060584699997434655 1457.9482074699997 1457.9482074699997 1457.9482074699997 1457.9482074699997 1457.9482074699997 2.5300003017036943E-6 1457.9482074699997 1457.9482074699997 1457.9482074699997 1457.9482074699997 1457.9482074699997 4.155476832923182 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017353156228327503 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.780341413129662 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 33.90170706564831 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.92 1.3791986760991028 9.177681877882348 3.8231 4.0464 14 0 0 0 0 0 13 0 0 0 0 0 -0 Cer(d16:0_16:0)+H Cer(d32:0)+H Cer (d16:0_16:0) (d16:0) (16:0) 512.5037204700001 C32 H66 O3 N1 2078469.997 1847819.103 7.149 3.014158825855122 20.5049767849842 0.99 70.30368681251827 0.0 0.0 1991720.714 0.0 0.0 0.0 0.0 0.0 2078469.997 0.0 0.0 0.0 0.0 0.0 1847819.103 0.0 0.0 0.0 0.0 0.0 1379834.84 0.0 0.0 0.0 7.15 7.152 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -471 -470 1835 -469 -468 -467 -466 -465 -464 -463 -462 -461 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 512.503496 512.50372 7.149 7.149 7.15 7.149 7.149 7.149 7.149 7.149 7.152 7.149 7.149 7.149 1229080.25 1 1 1 1 1 1 1 1 1 1 1 1 512.5037204700001 512.5037204700001 2.244700000346711E-4 512.5037204700001 512.5037204700001 512.5037204700001 512.5037204700001 512.5037204700001 4.70000031782547E-7 512.5037204700001 512.5037204700001 512.5037204700001 1000000.0 1000000.0 0.43798706442329266 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 9.170665753441276E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 15.883239294068703 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 39.70809823517176 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 1783873.75 70.30368681251827 4.6982 4.1414 0 0 4 0 0 0 0 0 5 0 0 0 -0 Cer(d16:1_16:0)+H Cer(d32:1)+H Cer (d16:1_16:0) (d16:1) (16:0) 510.48807046999997 C32 H64 O3 N1 1.2425338331E7 4826888.83 7.5651015429813135 18.30942372301358 10.34737441408115 0.99 16.095724772724093 0.0 0.0 9576785.479 0.0 0.0 0.0 0.0 0.0 1.2425338331E7 0.0 0.0 0.0 0.0 0.0 4168708.113 0.0 0.0 0.0 0.0 0.0 4826888.83 0.0 0.0 0.0 7.565 7.567 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.96 0.96 -481 -480 2025 -479 -478 -477 -476 -475 2119 -474 -473 -472 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 510.48801 510.488234 7.5651015429813135 7.5651015429813135 7.565 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.567 7.5651015429813135 7.5651015429813135 7.5651015429813135 3955257.0 4715266.0 1 1 1 1 1 1 1 1 1 1 1 1 510.48807046999997 510.48807046999997 6.046999999398395E-5 510.48807046999997 510.48807046999997 510.48807046999997 510.48807046999997 510.48807046999997 1.635300000089046E-4 510.48807046999997 510.48807046999997 510.48807046999997 1000000.0 1000000.0 0.11845526564080132 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3203404926942653 1000000.0 1000000.0 1000000.0 0.0 0.0 20.507026195820202 0.0 0.0 0.0 0.0 0.0 21.524266459165304 0.0 0.0 0.0 B B 0.0 0.0 51.267565489550506 0.0 0.0 0.0 0.0 0.0 53.81066614791327 0.0 0.0 0.0 0.99 0.99 17.064537818279838 16.095724772724093 4.3853 4.1077 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d32:1)+H-H2O Cer(d32:1)+H-H2O Cer (d16:1_16:0) (d16:1) (16:0) 492.4775054699999 C32 H62 O2 N1 4.0809256511E7 1.7936544153E7 7.5651015429813135 7.026760346149234 16.597219176711604 1.0 39.199866568746984 0.0 0.0 3.694586138E7 0.0 0.0 0.0 0.0 0.0 4.0809256511E7 0.0 0.0 0.0 0.0 0.0 1.4168673777E7 0.0 0.0 0.0 0.0 0.0 1.7936544153E7 0.0 0.0 0.0 7.565 7.564 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 1.0 -491 -490 2016 -489 -488 -487 -486 -485 2112 -484 -483 -482 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 492.477647 492.477265 7.5651015429813135 7.5651015429813135 7.565 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.5651015429813135 7.564 7.5651015429813135 7.5651015429813135 7.5651015429813135 2277733.0 3918290.0 1 1 1 1 1 1 1 1 1 1 1 1 492.4775054699999 492.4775054699999 1.4153000006444927E-4 492.4775054699999 492.4775054699999 492.4775054699999 492.4775054699999 492.4775054699999 2.4046999993743157E-4 492.4775054699999 492.4775054699999 492.4775054699999 1000000.0 1000000.0 0.28738368451850194 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.48828626133479347 1000000.0 1000000.0 1000000.0 0.0 0.0 9.500984036440924 0.0 0.0 0.0 0.0 0.0 9.431543072428703 0.0 0.0 0.0 C C 0.0 0.0 47.50492018220462 0.0 0.0 0.0 0.0 0.0 47.15771536214351 0.0 0.0 0.0 1.0 1.0 105.98293064104232 39.199866568746984 13.24 20.8463 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d17:0_16:0)+H Cer(d33:0)+H Cer (d17:0_16:0) (d17:0) (16:0) 526.51937047 C33 H68 O3 N1 8549335.221 4700226.974 7.393 1.464069205263849 9.472060958551817 1.0 4570024.0 0.0 0.0 8549335.221 0.0 0.0 0.0 0.0 0.0 8374134.449 0.0 0.0 0.0 0.0 0.0 4700226.974 0.0 0.0 0.0 0.0 0.0 4110130.504 0.0 0.0 0.0 7.397 7.392 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 1.0 0.97 -502 -501 -500 -499 -498 -497 -496 -495 2048 -494 -493 -492 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 526.51937 526.519315 7.393 7.393 7.397 7.393 7.393 7.393 7.393 7.393 7.392 7.393 7.393 7.393 3678309.25 1 1 1 1 1 1 1 1 1 1 1 1 526.51937047 526.51937047 4.70000031782547E-7 526.51937047 526.51937047 526.51937047 526.51937047 526.51937047 5.5470000006607734E-5 526.51937047 526.51937047 526.51937047 1000000.0 1000000.0 8.926547780435869E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10535224935236889 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.209383056561316 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.36461018853772 0.0 0.0 0.0 1.0 1.0 4570024.0 12.984405003808456 18.9314 13.771 0 0 6 0 0 0 0 0 7 0 0 0 -0 Cer(d33:1)+H-H2O Cer(d33:1)+H-H2O Cer (d33:1) (d33:1) 506.49315547 C33 H64 O2 N1 3.3716442124E7 1.4165365507E7 7.793 6.0670860025940625 5.070241618842523 0.98 1.4231331E7 0.0 0.0 3.3716442124E7 0.0 0.0 0.0 0.0 0.0 3.0942522338E7 0.0 0.0 0.0 0.0 0.0 1.4165365507E7 0.0 0.0 0.0 0.0 0.0 1.3184806529E7 0.0 0.0 0.0 7.792 7.794 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 1.0 0.93 -513 -512 2137 -511 -510 -509 -508 -507 -506 -505 -504 -503 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 506.493225 506.49316 7.793 7.793 7.792 7.793 7.793 7.793 7.793 7.793 7.794 7.793 7.793 7.793 1.4231331E7 1 1 1 1 1 1 1 1 1 1 1 1 506.49315547 506.49315547 6.953000001885812E-5 506.49315547 506.49315547 506.49315547 506.49315547 506.49315547 4.530000012437085E-6 506.49315547 506.49315547 506.49315547 1000000.0 1000000.0 0.1372772746639346 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00894385237690621 1000000.0 1000000.0 1000000.0 0.0 0.0 7.213681344033223 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 36.06840672016612 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 1.4231331E7 1.4816719E7 7.314 7.5358 0 0 12 0 0 0 0 0 9 0 0 0 -0 Cer(d18:0_16:0)+H Cer(d34:0)+H Cer (d18:0_16:0) (d18:0) (16:0) 540.5350204700001 C34 H70 O3 N1 4.979573854E7 2.1943350604E7 7.605621015902118 15.388124189057988 16.719149048033895 1.0 40.545242006023926 0.0 0.0 4.0022566578E7 0.0 0.0 0.0 0.0 0.0 4.979573854E7 0.0 0.0 0.0 0.0 0.0 1.7303500128E7 0.0 0.0 0.0 0.0 0.0 2.1943350604E7 0.0 0.0 0.0 7.607 7.607 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.92 0.97 -523 -522 2042 -521 -520 -519 -518 -517 2132 -516 -515 -514 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 540.534369 540.534334 7.605621015902118 7.605621015902118 7.607 7.605621015902118 7.605621015902118 7.605621015902118 7.605621015902118 7.605621015902118 7.607 7.605621015902118 7.605621015902118 7.605621015902118 4167409.0 5457884.0 1 1 1 1 1 1 1 1 1 1 1 1 540.5350204700001 540.5350204700001 6.514700000934681E-4 540.5350204700001 540.5350204700001 540.5350204700001 540.5350204700001 540.5350204700001 6.864700001187884E-4 540.5350204700001 540.5350204700001 540.5350204700001 1000000.0 1000000.0 1.2052318081574236 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2699824694464692 1000000.0 1000000.0 1000000.0 0.0 0.0 15.929167247803088 0.0 0.0 0.0 0.0 0.0 15.503734680105048 0.0 0.0 0.0 B B 0.0 0.0 31.85833449560618 0.0 0.0 0.0 0.0 0.0 31.007469360210095 0.0 0.0 0.0 0.99 1.0 119.58453231334636 40.545242006023926 22.1651 8.818 0 0 9 0 0 0 0 0 9 0 0 0 -0 Cer(d18:0_16:0)+H Cer(d34:0)+H Cer (d18:0_16:0) (d18:0) (16:0) 540.5350204700001 C34 H70 O3 N1 2.7329317131E7 1.0922222379E7 8.132 7.6213845518504675 1.9168317133816906 1.0 1.2166896E7 0.0 0.0 2.4534317062E7 0.0 0.0 0.0 0.0 0.0 2.7329317131E7 0.0 0.0 0.0 0.0 0.0 1.0630101172E7 0.0 0.0 0.0 0.0 0.0 1.0922222379E7 0.0 0.0 0.0 8.132 8.137 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.92 0.95 -534 -533 2291 -532 -531 -530 -529 -528 -527 -526 -525 -524 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 540.535017 540.53502 8.132 8.132 8.132 8.132 8.132 8.132 8.132 8.132 8.137 8.132 8.132 8.132 1.2006032E7 1 1 1 1 1 1 1 1 1 1 1 1 540.5350204700001 540.5350204700001 3.470000024208275E-6 540.5350204700001 540.5350204700001 540.5350204700001 540.5350204700001 540.5350204700001 4.70000031782547E-7 540.5350204700001 540.5350204700001 540.5350204700001 1000000.0 1000000.0 0.006419565602226992 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 8.695089383364611E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 12.61191299231581 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 31.529782480789525 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.2340984E7 1.2166896E7 15.5473 14.1739 0 0 11 0 0 0 0 0 10 0 0 0 -0 Cer(d18:0_16:0+O)+H Cer(d34:0+O)+H Cer (d18:0_16:0+O) (d18:0) (16:0+O) 556.5299354700002 C34 H70 O4 N1 2.1953284495E7 1.1103091878E7 7.48270215833222 1.8374055231807103 5.1898219189367145 0.99 37.671532600198034 0.0 0.0 2.1953284495E7 0.0 0.0 0.0 0.0 0.0 2.1390148451E7 0.0 0.0 0.0 0.0 0.0 1.1103091878E7 0.0 0.0 0.0 0.0 0.0 1.0317025354E7 0.0 0.0 0.0 7.484 7.477 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -544 -543 1984 -542 -541 -540 -539 -538 2088 -537 -536 -535 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 556.530602 556.530572 7.48270215833222 7.48270215833222 7.484 7.48270215833222 7.48270215833222 7.48270215833222 7.48270215833222 7.48270215833222 7.477 7.48270215833222 7.48270215833222 7.48270215833222 7798207.0 8295593.0 1 1 1 1 1 1 1 1 1 1 1 1 556.5299354700002 556.5299354700002 6.665299998758201E-4 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 556.5299354700002 6.36529999837876E-4 556.5299354700002 556.5299354700002 556.5299354700002 1000000.0 1000000.0 1.1976534547291204 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1437479985695902 1000000.0 1000000.0 1000000.0 0.0 0.0 8.893569753592075 0.0 0.0 0.0 0.0 0.0 7.689102568639698 0.0 0.0 0.0 B B 0.0 0.0 29.645232511973585 0.0 0.0 0.0 0.0 0.0 25.630341895465662 0.0 0.0 0.0 0.99 0.98 37.671532600198034 30.909937167659113 10.5804 16.9081 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d34:1)+H-H2O Cer(d34:1)+H-H2O Cer (d34:1) (d34:1) 520.50880547 C34 H66 O2 N1 3.9383665478E7 1.6524419447E7 7.460145954270143 0.98645112632574 5.881922254857961 0.99 1.6548241E7 0.0 0.0 3.8838048466E7 0.0 0.0 0.0 0.0 0.0 3.9383665478E7 0.0 0.0 0.0 0.0 0.0 1.5204756348E7 0.0 0.0 0.0 0.0 0.0 1.6524419447E7 0.0 0.0 0.0 7.462 7.456 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 1.0 -554 -553 1972 -552 -551 -550 -549 -548 2070 -547 -546 -545 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.509155 520.508972 7.460145954270143 7.460145954270143 7.462 7.460145954270143 7.460145954270143 7.460145954270143 7.460145954270143 7.460145954270143 7.456 7.460145954270143 7.460145954270143 7.460145954270143 1.1778909E7 1.1997989E7 1 1 1 1 1 1 1 1 1 1 1 1 520.50880547 520.50880547 3.495299999940471E-4 520.50880547 520.50880547 520.50880547 520.50880547 520.50880547 1.6653000000133034E-4 520.50880547 520.50880547 520.50880547 1000000.0 1000000.0 0.6715160172524547 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.31993695063613764 1000000.0 1000000.0 1000000.0 0.0 0.0 9.642463528290342 0.0 0.0 0.0 0.0 0.0 9.992407216012372 0.0 0.0 0.0 C C 0.0 0.0 48.21231764145172 0.0 0.0 0.0 0.0 0.0 49.962036080061864 0.0 0.0 0.0 0.99 0.99 1.7874066E7 1.6548241E7 11.654 9.9302 0 0 8 0 0 0 0 0 12 0 0 0 -0 Cer(d34:1)+H-H2O Cer(d34:1)+H-H2O Cer (d34:1) (d34:1) 520.50880547 C34 H66 O2 N1 1.99598805862E8 9.2743346285E7 8.004045569020624 5.476805563312862 18.070622294608395 0.99 67.79385258573443 0.0 0.0 1.84715517508E8 0.0 0.0 0.0 0.0 0.0 1.99598805862E8 0.0 0.0 0.0 0.0 0.0 7.1727493369E7 0.0 0.0 0.0 0.0 0.0 9.2743346285E7 0.0 0.0 0.0 8.003 8.005 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 1.0 -564 -563 2215 -562 -561 -560 -559 -558 2316 -557 -556 -555 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.50885 520.509033 8.004045569020624 8.004045569020624 8.003 8.004045569020624 8.004045569020624 8.004045569020624 8.004045569020624 8.004045569020624 8.005 8.004045569020624 8.004045569020624 8.004045569020624 8718000.0 3.3543616E7 1 1 1 1 1 1 1 1 1 1 1 1 520.50880547 520.50880547 4.453000008197705E-5 520.50880547 520.50880547 520.50880547 520.50880547 520.50880547 2.2753000007469382E-4 520.50880547 520.50880547 520.50880547 1000000.0 1000000.0 0.08555090637086941 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.43712997298718653 1000000.0 1000000.0 1000000.0 0.0 0.0 5.306609262540232 0.0 0.0 0.0 0.0 0.0 5.621267866157663 0.0 0.0 0.0 C C 0.0 0.0 26.533046312701163 0.0 0.0 0.0 0.0 0.0 28.106339330788316 0.0 0.0 0.0 0.99 0.99 549.8369437164766 67.79385258573443 63.8556 55.2587 0 0 9 0 0 0 0 0 8 0 0 0 -0 Cer(d18:1_16:1)+H Cer(d34:2)+H Cer (d18:1_16:1) (d18:1) (16:1) 536.5037204700001 C34 H66 O3 N1 1.9655287104E7 7986336.974 7.32622183684489 9.427847824474975 0.4695998056935144 0.99 21.19439971965711 0.0 0.0 1.7198435483E7 0.0 0.0 0.0 0.0 0.0 1.9655287104E7 0.0 0.0 0.0 0.0 0.0 7933474.094 0.0 0.0 0.0 0.0 0.0 7986336.974 0.0 0.0 0.0 7.324 7.325 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 1.0 0.96 -574 -573 1909 -572 -571 -570 -569 -568 2009 -567 -566 -565 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 536.503845 536.503845 7.32622183684489 7.32622183684489 7.324 7.32622183684489 7.32622183684489 7.32622183684489 7.32622183684489 7.32622183684489 7.325 7.32622183684489 7.32622183684489 7.32622183684489 3818775.5 9812447.0 1 1 1 1 1 1 1 1 1 1 1 1 536.5037204700001 536.5037204700001 1.2452999987999647E-4 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 536.5037204700001 1.2452999987999647E-4 536.5037204700001 536.5037204700001 536.5037204700001 1000000.0 1000000.0 0.23211395397389398 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.23211395397389398 1000000.0 1000000.0 1000000.0 0.0 0.0 17.097845321319845 0.0 0.0 0.0 0.0 0.0 19.686342570607806 0.0 0.0 0.0 B B 0.0 0.0 42.74461330329961 0.0 0.0 0.0 0.0 0.0 49.215856426519515 0.0 0.0 0.0 0.99 0.99 66.98945633996874 21.19439971965711 12.9069 10.9534 0 0 8 0 0 0 0 0 11 0 0 0 -0 Cer(d18:0_17:0+O)+H Cer(d35:0+O)+H Cer (d18:0_17:0+O) (d18:0) (17:0+O) 570.54558547 C35 H72 O4 N1 7286568.867 2839872.69 7.634 17.61993149893761 15.186733703185734 0.89 2764423.25 0.0 0.0 7286568.867 0.0 0.0 0.0 0.0 0.0 5672034.099 0.0 0.0 0.0 0.0 0.0 2839872.69 0.0 0.0 0.0 0.0 0.0 2289091.561 0.0 0.0 0.0 7.633 7.634 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 1.0 0.96 -585 -584 2070 -583 -582 -581 -580 -579 -578 -577 -576 -575 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 570.545253 570.54559 7.634 7.634 7.633 7.634 7.634 7.634 7.634 7.634 7.634 7.634 7.634 7.634 1708222.25 1 1 1 1 1 1 1 1 1 1 1 1 570.54558547 570.54558547 3.32469999989371E-4 570.54558547 570.54558547 570.54558547 570.54558547 570.54558547 4.5299999555936665E-6 570.54558547 570.54558547 570.54558547 1000000.0 1000000.0 0.5827229382828214 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00793976865470263 1000000.0 1000000.0 1000000.0 0.0 0.0 5.993716266754485 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 19.97905422251495 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.98 2764423.25 2.321210502353539 3.0407 3.3844 0 0 11 0 0 0 0 0 8 0 0 0 -0 Cer(d35:1)+H-H2O Cer(d35:1)+H-H2O Cer (d35:1) (d35:1) 534.52445547 C35 H68 O2 N1 7995648.042 3936031.101 7.613270140737783 47.60187385465803 57.274726169852016 0.99 3892275.25 0.0 0.0 3968546.936 0.0 0.0 0.0 0.0 0.0 7995648.042 0.0 0.0 0.0 0.0 0.0 1666886.176 0.0 0.0 0.0 0.0 0.0 3936031.101 0.0 0.0 0.0 7.613 7.613 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.85 1.0 -595 -594 2057 -593 -592 -591 -590 -589 2149 -588 -587 -586 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 534.525784 534.524607 7.613270140737783 7.613270140737783 7.613 7.613270140737783 7.613270140737783 7.613270140737783 7.613270140737783 7.613270140737783 7.613 7.613270140737783 7.613270140737783 7.613270140737783 1400623.25 3892275.25 1 1 1 1 1 1 1 1 1 1 1 1 534.52445547 534.52445547 0.0013285300000234201 534.52445547 534.52445547 534.52445547 534.52445547 534.52445547 1.5152999992551486E-4 534.52445547 534.52445547 534.52445547 1000000.0 1000000.0 2.485442876238959 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.28348562610157213 1000000.0 1000000.0 1000000.0 0.0 0.0 8.466376036675886 0.0 0.0 0.0 0.0 0.0 7.900468935685819 0.0 0.0 0.0 C C 0.0 0.0 42.331880183379425 0.0 0.0 0.0 0.0 0.0 39.50234467842909 0.0 0.0 0.0 0.91 0.99 2137398.5 3892275.25 3.3125 5.1588 0 0 6 0 0 0 0 0 7 0 0 0 -0 Cer(d35:1)+H-H2O Cer(d35:1)+H-H2O Cer (d35:1) (d35:1) 534.52445547 C35 H68 O2 N1 2.3646972012E7 9082289.545 8.141 4.314595195590265 2.7367108931540396 0.96 1.0059443E7 0.0 0.0 2.2246808074E7 0.0 0.0 0.0 0.0 0.0 2.3646972012E7 0.0 0.0 0.0 0.0 0.0 8737451.393 0.0 0.0 0.0 0.0 0.0 9082289.545 0.0 0.0 0.0 8.142 8.146 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.88 0.92 -606 -605 2298 -604 -603 -602 -601 -600 -599 -598 -597 -596 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 534.524902 534.52446 8.141 8.141 8.142 8.141 8.141 8.141 8.141 8.141 8.146 8.141 8.141 8.141 9596121.0 1 1 1 1 1 1 1 1 1 1 1 1 534.52445547 534.52445547 4.465299999765193E-4 534.52445547 534.52445547 534.52445547 534.52445547 534.52445547 4.5299999555936665E-6 534.52445547 534.52445547 534.52445547 1000000.0 1000000.0 0.835378055030039 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.008474822637648075 1000000.0 1000000.0 1000000.0 0.0 0.0 6.37332159345603 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 31.866607967280153 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.88 0.96 1.0299789E7 1.0059443E7 4.4786 4.0134 0 0 7 0 0 0 0 0 7 0 0 0 -0 Cer(d16:1_20:0)+H Cer(d36:1)+H Cer (d16:1_20:0) (d16:1) (20:0) 566.55067047 C36 H72 O3 N1 4.7344143745E7 1.6704840398E7 8.380731826403736 11.011329836948642 0.10047040533021036 0.99 75.739853641939 0.0 0.0 4.0504114929E7 0.0 0.0 0.0 0.0 0.0 4.7344143745E7 0.0 0.0 0.0 0.0 0.0 1.6704840398E7 0.0 0.0 0.0 0.0 0.0 1.6681121907E7 0.0 0.0 0.0 8.376 8.386 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 1.0 0.95 -616 -615 2400 -614 -613 -612 -611 -610 2491 -609 -608 -607 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 566.551002 566.551097 8.380731826403736 8.380731826403736 8.376 8.380731826403736 8.380731826403736 8.380731826403736 8.380731826403736 8.380731826403736 8.386 8.380731826403736 8.380731826403736 8.380731826403736 8584388.0 1.2593925E7 1 1 1 1 1 1 1 1 1 1 1 1 566.55067047 566.55067047 3.3153000003949273E-4 566.55067047 566.55067047 566.55067047 566.55067047 566.55067047 4.2653000002701447E-4 566.55067047 566.55067047 566.55067047 1000000.0 1000000.0 0.5851727256177484 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.752854108659289 1000000.0 1000000.0 1000000.0 0.0 0.0 18.549562715977206 0.0 0.0 0.0 0.0 0.0 19.807331671894076 0.0 0.0 0.0 B B 0.0 0.0 46.373906789943014 0.0 0.0 0.0 0.0 0.0 49.51832917973519 0.0 0.0 0.0 0.99 0.99 119.75282465461194 75.739853641939 25.0229 68.6096 0 0 9 0 0 0 0 0 9 0 0 0 -0 Cer(d36:1)+H-H2O Cer(d36:1)+H-H2O Cer (d16:1_20:0) (d16:1) (20:0) 548.54010547 C36 H70 O2 N1 1.01473905176E8 3.8586071256E7 8.380731826403736 6.868406278428668 6.764659018948486 0.99 263.7542403318638 0.0 0.0 9.2073876535E7 0.0 0.0 0.0 0.0 0.0 1.01473905176E8 0.0 0.0 0.0 0.0 0.0 3.5063179916E7 0.0 0.0 0.0 0.0 0.0 3.8586071256E7 0.0 0.0 0.0 8.378 8.386 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.98 0.96 -626 -625 2397 -624 -623 -622 -621 -620 2489 -619 -618 -617 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 548.540213 548.540222 8.380731826403736 8.380731826403736 8.378 8.380731826403736 8.380731826403736 8.380731826403736 8.380731826403736 8.380731826403736 8.386 8.380731826403736 8.380731826403736 8.380731826403736 1.9859932E7 2.6705574E7 1 1 1 1 1 1 1 1 1 1 1 1 548.54010547 548.54010547 1.0753000003660418E-4 548.54010547 548.54010547 548.54010547 548.54010547 548.54010547 1.1653000001388136E-4 548.54010547 548.54010547 548.54010547 1000000.0 1000000.0 0.19602942239650892 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.21243660919566887 1000000.0 1000000.0 1000000.0 0.0 0.0 8.270357408475663 0.0 0.0 0.0 0.0 0.0 8.811402473305508 0.0 0.0 0.0 C C 0.0 0.0 41.35178704237831 0.0 0.0 0.0 0.0 0.0 44.05701236652754 0.0 0.0 0.0 0.99 0.99 151.5791967749625 263.7542403318638 50.8416 64.1784 0 0 8 0 0 0 0 0 9 0 0 0 -0 Cer(d16:1_21:0)+H Cer(d37:1)+H Cer (d16:1_21:0) (d16:1) (21:0) 580.56632047 C37 H74 O3 N1 8546456.339 2900998.989 8.55538352510681 10.813745590487764 5.027712132042529 0.96 50.0099059461083 0.0 0.0 7332292.149 0.0 0.0 0.0 0.0 0.0 8546456.339 0.0 0.0 0.0 0.0 0.0 2701811.818 0.0 0.0 0.0 0.0 0.0 2900998.989 0.0 0.0 0.0 8.553 8.562 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -636 -635 2479 -634 -633 -632 -631 -630 2568 -629 -628 -627 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 580.566166 580.566544 8.55538352510681 8.55538352510681 8.553 8.55538352510681 8.55538352510681 8.55538352510681 8.55538352510681 8.55538352510681 8.562 8.55538352510681 8.55538352510681 8.55538352510681 2680700.5 2902601.25 1 1 1 1 1 1 1 1 1 1 1 1 580.56632047 580.56632047 1.5447000009771727E-4 580.56632047 580.56632047 580.56632047 580.56632047 580.56632047 2.23529999971106E-4 580.56632047 580.56632047 580.56632047 1000000.0 1000000.0 0.26606779389590735 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.38502061192620735 1000000.0 1000000.0 1000000.0 0.0 0.0 12.14909844957312 0.0 0.0 0.0 0.0 0.0 11.641131873710517 0.0 0.0 0.0 B B 0.0 0.0 30.3727461239328 0.0 0.0 0.0 0.0 0.0 29.102829684276294 0.0 0.0 0.0 0.94 0.96 90.02253978995483 50.0099059461083 4.3958 4.5428 0 0 12 0 0 0 0 0 13 0 0 0 -0 Cer(d37:1)+H-H2O Cer(d37:1)+H-H2O Cer (d16:1_21:0) (d16:1) (21:0) 562.55575547 C37 H72 O2 N1 1.7373202059E7 6012106.989 8.55538352510681 8.566318787128218 3.386218520557883 0.94 5861111.0 0.0 0.0 1.5388713838E7 0.0 0.0 0.0 0.0 0.0 1.7373202059E7 0.0 0.0 0.0 0.0 0.0 5730929.598 0.0 0.0 0.0 0.0 0.0 6012106.989 0.0 0.0 0.0 8.553 8.556 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -646 -645 2472 -644 -643 -642 -641 -640 2560 -639 -638 -637 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 562.555542 562.556366 8.55538352510681 8.55538352510681 8.553 8.55538352510681 8.55538352510681 8.55538352510681 8.55538352510681 8.55538352510681 8.556 8.55538352510681 8.55538352510681 8.55538352510681 2836974.75 4200200.0 1 1 1 1 1 1 1 1 1 1 1 1 562.55575547 562.55575547 2.1347000006244343E-4 562.55575547 562.55575547 562.55575547 562.55575547 562.55575547 6.105300000172065E-4 562.55575547 562.55575547 562.55575547 1000000.0 1000000.0 0.3794646094840769 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.085279092926754 1000000.0 1000000.0 1000000.0 0.0 0.0 5.371392718576456 0.0 0.0 0.0 0.0 0.0 5.187790476491456 0.0 0.0 0.0 C C 0.0 0.0 26.856963592882284 0.0 0.0 0.0 0.0 0.0 25.938952382457277 0.0 0.0 0.0 0.97 0.94 5752719.0 5861111.0 7.8334 5.5419 0 0 13 0 0 0 0 0 12 0 0 0 -0 Cer(d16:0_22:0)+H Cer(d38:0)+H Cer (d16:0_22:0) (d16:0) (22:0) 596.59762047 C38 H78 O3 N1 1.2811167017E7 5374210.88 8.807 7.566819420391366 8.819943626322459 0.99 6433019.5 0.0 0.0 1.1509858548E7 0.0 0.0 0.0 0.0 0.0 1.2811167017E7 0.0 0.0 0.0 0.0 0.0 4743222.769 0.0 0.0 0.0 0.0 0.0 5374210.88 0.0 0.0 0.0 8.805 8.812 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.96 0.92 -657 -656 2599 -655 -654 -653 -652 -651 -650 -649 -648 -647 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 596.597455 596.59762 8.807 8.807 8.805 8.807 8.807 8.807 8.807 8.807 8.812 8.807 8.807 8.807 5081668.0 1 1 1 1 1 1 1 1 1 1 1 1 596.59762047 596.59762047 1.6547000006994494E-4 596.59762047 596.59762047 596.59762047 596.59762047 596.59762047 4.70000031782547E-7 596.59762047 596.59762047 596.59762047 1000000.0 1000000.0 0.2773561180810402 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.878007146798217E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 10.139092950548545 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 25.34773237637136 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 5432091.5 6433019.5 11.4019 10.4838 0 0 11 0 0 0 0 0 11 0 0 0 -0 Cer(d16:1_22:0)+H Cer(d38:1)+H Cer (d16:1_22:0) (d16:1) (22:0) 594.5819704700001 C38 H76 O3 N1 6.4287991144E7 2.5363391166E7 8.714955721224923 9.652275572319564 7.354298571896633 0.99 86.4930349642062 0.0 0.0 5.6073117389E7 0.0 0.0 0.0 0.0 0.0 6.4287991144E7 0.0 0.0 0.0 0.0 0.0 2.2855857905E7 0.0 0.0 0.0 0.0 0.0 2.5363391166E7 0.0 0.0 0.0 8.713 8.718 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.98 0.95 -667 -666 2540 -665 -664 -663 -662 -661 2626 -660 -659 -658 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 594.582191 594.582154 8.714955721224923 8.714955721224923 8.713 8.714955721224923 8.714955721224923 8.714955721224923 8.714955721224923 8.714955721224923 8.718 8.714955721224923 8.714955721224923 8.714955721224923 1.3044452E7 9975154.0 1 1 1 1 1 1 1 1 1 1 1 1 594.5819704700001 594.5819704700001 2.2052999986499344E-4 594.5819704700001 594.5819704700001 594.5819704700001 594.5819704700001 594.5819704700001 1.8352999984472262E-4 594.5819704700001 594.5819704700001 594.5819704700001 1000000.0 1000000.0 0.37089923814990683 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.30867064418325263 1000000.0 1000000.0 1000000.0 0.0 0.0 19.667812427919408 0.0 0.0 0.0 0.0 0.0 19.08831360327754 0.0 0.0 0.0 B B 0.0 0.0 49.16953106979852 0.0 0.0 0.0 0.0 0.0 47.72078400819385 0.0 0.0 0.0 1.0 0.99 2.7984448E7 86.4930349642062 94.7803 89.3355 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d38:1)+H-H2O Cer(d38:1)+H-H2O Cer (d16:1_22:0) (d16:1) (22:0) 576.5714054700001 C38 H74 O2 N1 1.23544884456E8 4.8758920068E7 8.714955721224923 9.023066350568449 5.686728515815396 0.99 270.1899380941906 0.0 0.0 1.08725409323E8 0.0 0.0 0.0 0.0 0.0 1.23544884456E8 0.0 0.0 0.0 0.0 0.0 4.4989191958E7 0.0 0.0 0.0 0.0 0.0 4.8758920068E7 0.0 0.0 0.0 8.713 8.72 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.94 0.93 -677 -676 2538 -675 -674 -673 -672 -671 2624 -670 -669 -668 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 576.571533 576.571439 8.714955721224923 8.714955721224923 8.713 8.714955721224923 8.714955721224923 8.714955721224923 8.714955721224923 8.714955721224923 8.72 8.714955721224923 8.714955721224923 8.714955721224923 8279229.5 2.0501544E7 1 1 1 1 1 1 1 1 1 1 1 1 576.5714054700001 576.5714054700001 1.2752999998610903E-4 576.5714054700001 576.5714054700001 576.5714054700001 576.5714054700001 576.5714054700001 3.352999999606254E-5 576.5714054700001 576.5714054700001 576.5714054700001 1000000.0 1000000.0 0.22118682747048687 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.05815411530637754 1000000.0 1000000.0 1000000.0 0.0 0.0 9.293617893608221 0.0 0.0 0.0 0.0 0.0 10.279670450972915 0.0 0.0 0.0 C C 0.0 0.0 46.4680894680411 0.0 0.0 0.0 0.0 0.0 51.39835225486458 0.0 0.0 0.0 1.0 0.99 5.3008904E7 270.1899380941906 51.0254 70.0645 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d16:1_22:1)+H Cer(d38:2)+H Cer (d16:1_22:1) (d16:1) (22:1) 592.56632047 C38 H74 O3 N1 1.7601348853E7 6802808.098 8.397483757298856 6.33576860318472 5.503735687405756 0.98 70.76842273513937 0.0 0.0 1.6091870734E7 0.0 0.0 0.0 0.0 0.0 1.7601348853E7 0.0 0.0 0.0 0.0 0.0 6293148.962 0.0 0.0 0.0 0.0 0.0 6802808.098 0.0 0.0 0.0 8.397 8.398 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -688 -687 2409 -686 -685 -684 -683 -682 -681 -680 -679 -678 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 592.566161 592.56632 8.397483757298856 8.397483757298856 8.397 8.397483757298856 8.397483757298856 8.397483757298856 8.397483757298856 8.397483757298856 8.398 8.397483757298856 8.397483757298856 8.397483757298856 4056893.0 1 1 1 1 1 1 1 1 1 1 1 1 592.56632047 592.56632047 1.594700000850935E-4 592.56632047 592.56632047 592.56632047 592.56632047 592.56632047 4.70000031782547E-7 592.56632047 592.56632047 592.56632047 1000000.0 1000000.0 0.26911755625700806 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.931602177622273E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 19.234302954915314 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 48.08575738728828 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 47.06852003910489 70.76842273513937 10.7832 15.4977 0 0 10 0 0 0 0 0 11 0 0 0 -0 Cer(d38:2)+H-H2O Cer(d38:2)+H-H2O Cer (d16:1_22:1) (d16:1) (22:1) 574.55575547 C38 H72 O2 N1 3.3523735809E7 1.1355084968E7 8.397483757298856 4.715648811247218 3.8472740334685342 0.98 75.34884565105835 0.0 0.0 3.1360202146E7 0.0 0.0 0.0 0.0 0.0 3.3523735809E7 0.0 0.0 0.0 0.0 0.0 1.0753632012E7 0.0 0.0 0.0 0.0 0.0 1.1355084968E7 0.0 0.0 0.0 8.393 8.404 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -698 -697 2406 -696 -695 -694 -693 -692 2503 -691 -690 -689 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 574.556001 574.556046 8.397483757298856 8.397483757298856 8.393 8.397483757298856 8.397483757298856 8.397483757298856 8.397483757298856 8.397483757298856 8.404 8.397483757298856 8.397483757298856 8.397483757298856 8144256.0 1.1104784E7 1 1 1 1 1 1 1 1 1 1 1 1 574.55575547 574.55575547 2.455300000292482E-4 574.55575547 574.55575547 574.55575547 574.55575547 574.55575547 2.9053000002932095E-4 574.55575547 574.55575547 574.55575547 1000000.0 1000000.0 0.42733885735492966 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5056602379549059 1000000.0 1000000.0 1000000.0 0.0 0.0 9.05024849222873 0.0 0.0 0.0 0.0 0.0 9.301478166246579 0.0 0.0 0.0 C C 0.0 0.0 45.251242461143654 0.0 0.0 0.0 0.0 0.0 46.5073908312329 0.0 0.0 0.0 0.99 0.98 37.283677539343756 75.34884565105835 15.813 18.6562 0 0 11 0 0 0 0 0 11 0 0 0 -0 Cer(d16:0_23:0)+H Cer(d39:0)+H Cer (d16:0_23:0) (d16:0) (23:0) 610.6132704700001 C39 H80 O3 N1 1.1631085623E7 4680004.676 8.953157749782914 4.95594750001017 5.383045625517918 0.99 24.20938731419418 0.0 0.0 1.0843490166E7 0.0 0.0 0.0 0.0 0.0 1.1631085623E7 0.0 0.0 0.0 0.0 0.0 4680004.676 0.0 0.0 0.0 0.0 0.0 4336790.462 0.0 0.0 0.0 8.948 8.958 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 1.0 0.97 -708 -707 2653 -706 -705 -704 -703 -702 2736 -701 -700 -699 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 610.613098 610.613125 8.953157749782914 8.953157749782914 8.948 8.953157749782914 8.953157749782914 8.953157749782914 8.953157749782914 8.953157749782914 8.958 8.953157749782914 8.953157749782914 8.953157749782914 3217619.5 4841119.0 1 1 1 1 1 1 1 1 1 1 1 1 610.6132704700001 610.6132704700001 1.7247000005227164E-4 610.6132704700001 610.6132704700001 610.6132704700001 610.6132704700001 610.6132704700001 1.454700001204401E-4 610.6132704700001 610.6132704700001 610.6132704700001 1000000.0 1000000.0 0.2824537369119383 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.23823589685246963 1000000.0 1000000.0 1000000.0 0.0 0.0 12.33085722796357 0.0 0.0 0.0 0.0 0.0 15.526635719880014 0.0 0.0 0.0 B B 0.0 0.0 30.827143069908924 0.0 0.0 0.0 0.0 0.0 31.053271439760028 0.0 0.0 0.0 0.97 0.99 24.920894044041507 24.20938731419418 25.0611 18.8215 0 0 8 0 0 0 0 0 9 0 0 0 -0 Cer(d16:1_23:0)+H Cer(d39:1)+H Cer (d16:1_23:0) (d16:1) (23:0) 608.59762047 C39 H78 O3 N1 1.8243855132E7 7577815.738 8.867664944371576 10.971260891528019 10.227835037972515 0.99 74.72116959318875 0.0 0.0 1.5616981231E7 0.0 0.0 0.0 0.0 0.0 1.8243855132E7 0.0 0.0 0.0 0.0 0.0 6555658.631 0.0 0.0 0.0 0.0 0.0 7577815.738 0.0 0.0 0.0 8.862 8.877 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -718 -717 2619 -716 -715 -714 -713 -712 2699 -711 -710 -709 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 608.598 608.597839 8.867664944371576 8.867664944371576 8.862 8.867664944371576 8.867664944371576 8.867664944371576 8.867664944371576 8.867664944371576 8.877 8.867664944371576 8.867664944371576 8.867664944371576 6451653.0 6322939.0 1 1 1 1 1 1 1 1 1 1 1 1 608.59762047 608.59762047 3.795299999183044E-4 608.59762047 608.59762047 608.59762047 608.59762047 608.59762047 2.185299999837298E-4 608.59762047 608.59762047 608.59762047 1000000.0 1000000.0 0.6236140056301991 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3590714005995722 1000000.0 1000000.0 1000000.0 0.0 0.0 18.968637308259503 0.0 0.0 0.0 0.0 0.0 18.095037548226333 0.0 0.0 0.0 B B 0.0 0.0 47.421593270648756 0.0 0.0 0.0 0.0 0.0 45.23759387056583 0.0 0.0 0.0 1.0 0.99 76.34322580222526 74.72116959318875 14.4734 12.179 0 0 11 0 0 0 0 0 12 0 0 0 -0 Cer(d39:1)+H-H2O Cer(d39:1)+H-H2O Cer (d16:1_23:0) (d16:1) (23:0) 590.58705547 C39 H76 O2 N1 2.9735632894E7 1.2266019222E7 8.867664944371576 3.4487498753566803 10.138086619806986 1.0 103.82644033043412 0.0 0.0 2.8319871382E7 0.0 0.0 0.0 0.0 0.0 2.9735632894E7 0.0 0.0 0.0 0.0 0.0 1.0625026579E7 0.0 0.0 0.0 0.0 0.0 1.2266019222E7 0.0 0.0 0.0 8.866 8.871 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.92 0.91 -728 -727 2614 -726 -725 -724 -723 -722 2696 -721 -720 -719 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 590.587155 590.587764 8.867664944371576 8.867664944371576 8.866 8.867664944371576 8.867664944371576 8.867664944371576 8.867664944371576 8.867664944371576 8.871 8.867664944371576 8.867664944371576 8.867664944371576 6282128.5 5203224.5 1 1 1 1 1 1 1 1 1 1 1 1 590.58705547 590.58705547 9.953000005680224E-5 590.58705547 590.58705547 590.58705547 590.58705547 590.58705547 7.085299999971539E-4 590.58705547 590.58705547 590.58705547 1000000.0 1000000.0 0.16852722919501587 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.199704587892284 1000000.0 1000000.0 1000000.0 0.0 0.0 7.896389840701563 0.0 0.0 0.0 0.0 0.0 7.3402685291113565 0.0 0.0 0.0 C C 0.0 0.0 39.48194920350782 0.0 0.0 0.0 0.0 0.0 36.70134264555678 0.0 0.0 0.0 0.99 1.0 141.40268151965753 103.82644033043412 17.7144 19.3098 0 0 12 0 0 0 0 0 12 0 0 0 -0 Cer(d16:0_24:0)+H Cer(d40:0)+H Cer (d16:0_24:0) (d16:0) (24:0) 624.62892047 C40 H82 O3 N1 2.5320133757E7 1.0015040579E7 9.091 8.725743456562082 5.229546639473681 0.99 1.1554094E7 0.0 0.0 2.2377193242E7 0.0 0.0 0.0 0.0 0.0 2.5320133757E7 0.0 0.0 0.0 0.0 0.0 9300771.239 0.0 0.0 0.0 0.0 0.0 1.0015040579E7 0.0 0.0 0.0 9.089 9.098 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.93 0.93 -739 -738 2708 -737 -736 -735 -734 -733 -732 -731 -730 -729 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 624.629072 624.62892 9.091 9.091 9.089 9.091 9.091 9.091 9.091 9.091 9.098 9.091 9.091 9.091 2390706.0 1 1 1 1 1 1 1 1 1 1 1 1 624.62892047 624.62892047 1.5152999992551486E-4 624.62892047 624.62892047 624.62892047 624.62892047 624.62892047 4.70000031782547E-7 624.62892047 624.62892047 624.62892047 1000000.0 1000000.0 0.2425920333811899 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.524467990193233E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 13.483160231898792 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 26.966320463797583 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 1.0890051E7 1.1554094E7 10.2339 9.8132 0 0 11 0 0 0 0 0 11 0 0 0 -0 Cer(d16:1_24:0)+H Cer(d40:1)+H Cer (d16:1_24:0) (d16:1) (24:0) 622.6132704700001 C40 H80 O3 N1 8.1802581573E7 3.4024438051E7 9.011250841186088 6.882096513542328 9.412179406565425 1.0 60.066564967461 0.0 0.0 7.4210401472E7 0.0 0.0 0.0 0.0 0.0 8.1802581573E7 0.0 0.0 0.0 0.0 0.0 2.9778112938E7 0.0 0.0 0.0 0.0 0.0 3.4024438051E7 0.0 0.0 0.0 9.008 9.015 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.97 0.95 -749 -748 2671 -747 -746 -745 -744 -743 2756 -742 -741 -740 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 622.613047 622.613302 9.011250841186088 9.011250841186088 9.008 9.011250841186088 9.011250841186088 9.011250841186088 9.011250841186088 9.011250841186088 9.015 9.011250841186088 9.011250841186088 9.011250841186088 1.0627636E7 2.1161146E7 1 1 1 1 1 1 1 1 1 1 1 1 622.6132704700001 622.6132704700001 2.2347000003719586E-4 622.6132704700001 622.6132704700001 622.6132704700001 622.6132704700001 622.6132704700001 3.152999988742522E-5 622.6132704700001 622.6132704700001 622.6132704700001 1000000.0 1000000.0 0.35892264208969105 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.05064138749182741 1000000.0 1000000.0 1000000.0 0.0 0.0 17.17475244727171 0.0 0.0 0.0 0.0 0.0 21.487857044181688 0.0 0.0 0.0 B B 0.0 0.0 42.93688111817928 0.0 0.0 0.0 0.0 0.0 53.71964261045422 0.0 0.0 0.0 0.99 1.0 110.04427526465267 60.066564967461 56.9641 40.3261 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d40:1)+H-H2O Cer(d40:1)+H-H2O Cer (d16:1_24:0) (d16:1) (24:0) 604.60270547 C40 H78 O2 N1 1.53690372073E8 6.3011054356E7 9.011250841186088 6.789202522397615 7.9583300257848295 1.0 127.27578799606835 0.0 0.0 1.3960993043E8 0.0 0.0 0.0 0.0 0.0 1.53690372073E8 0.0 0.0 0.0 0.0 0.0 5.629711917E7 0.0 0.0 0.0 0.0 0.0 6.3011054356E7 0.0 0.0 0.0 9.008 9.012 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.94 0.97 -759 -758 2666 -757 -756 -755 -754 -753 2751 -752 -751 -750 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 604.602091 604.602481 9.011250841186088 9.011250841186088 9.008 9.011250841186088 9.011250841186088 9.011250841186088 9.011250841186088 9.011250841186088 9.012 9.011250841186088 9.011250841186088 9.011250841186088 6857248.5 1.7147782E7 1 1 1 1 1 1 1 1 1 1 1 1 604.60270547 604.60270547 6.144700000731973E-4 604.60270547 604.60270547 604.60270547 604.60270547 604.60270547 2.244700000346711E-4 604.60270547 604.60270547 604.60270547 1000000.0 1000000.0 1.016320295152379 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3712686000307836 1000000.0 1000000.0 1000000.0 0.0 0.0 5.700794741717275 0.0 0.0 0.0 0.0 0.0 7.2952308366536 0.0 0.0 0.0 C C 0.0 0.0 28.503973708586372 0.0 0.0 0.0 0.0 0.0 36.476154183268 0.0 0.0 0.0 0.99 1.0 133.73545425820166 127.27578799606835 76.1964 52.8675 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d16:1_24:1)+H Cer(d40:2)+H Cer (d16:1_24:1) (d16:1) (24:1) 620.59762047 C40 H78 O3 N1 2.8644137857E7 8510713.14 8.753342176282537 5.742255968119453 5.494220522820119 0.85 229.5008399871202 0.0 0.0 2.640877588E7 0.0 0.0 0.0 0.0 0.0 2.8644137857E7 0.0 0.0 0.0 0.0 0.0 7874160.695 0.0 0.0 0.0 0.0 0.0 8510713.14 0.0 0.0 0.0 8.753 8.757 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -769 -768 2551 -767 -766 -765 -764 -763 2640 -762 -761 -760 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 620.597556 620.597191 8.753342176282537 8.753342176282537 8.753 8.753342176282537 8.753342176282537 8.753342176282537 8.753342176282537 8.753342176282537 8.757 8.753342176282537 8.753342176282537 8.753342176282537 4754609.5 4783339.0 1 1 1 1 1 1 1 1 1 1 1 1 620.59762047 620.59762047 6.446999998388492E-5 620.59762047 620.59762047 620.59762047 620.59762047 620.59762047 4.2947000008553005E-4 620.59762047 620.59762047 620.59762047 1000000.0 1000000.0 0.10388373699380213 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6920265014233821 1000000.0 1000000.0 1000000.0 0.0 0.0 19.608223854269365 0.0 0.0 0.0 0.0 0.0 19.354259166204073 0.0 0.0 0.0 B B 0.0 0.0 49.020559635673415 0.0 0.0 0.0 0.0 0.0 48.385647915510184 0.0 0.0 0.0 0.82 0.85 7641724.0 229.5008399871202 19.5313 27.0013 0 0 12 0 0 0 0 0 12 0 0 0 -0 Cer(d40:2)+H-H2O Cer(d40:2)+H-H2O Cer (d16:1_24:1) (d16:1) (24:1) 602.58705547 C40 H76 O2 N1 5.0115441069E7 1.4696006869E7 8.753342176282537 8.153671470043886 3.4269636198888245 0.93 223.28268772715109 0.0 0.0 4.4651630053E7 0.0 0.0 0.0 0.0 0.0 5.0115441069E7 0.0 0.0 0.0 0.0 0.0 1.400062178E7 0.0 0.0 0.0 0.0 0.0 1.4696006869E7 0.0 0.0 0.0 8.75 8.754 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.85 0.88 -779 -778 2545 -777 -776 -775 -774 -773 2636 -772 -771 -770 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 602.587033 602.587152 8.753342176282537 8.753342176282537 8.75 8.753342176282537 8.753342176282537 8.753342176282537 8.753342176282537 8.753342176282537 8.754 8.753342176282537 8.753342176282537 8.753342176282537 6657061.0 7725814.5 1 1 1 1 1 1 1 1 1 1 1 1 602.58705547 602.58705547 2.2469999976237887E-5 602.58705547 602.58705547 602.58705547 602.58705547 602.58705547 9.652999995068967E-5 602.58705547 602.58705547 602.58705547 1000000.0 1000000.0 0.037289217835441146 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.16019262125602604 1000000.0 1000000.0 1000000.0 0.0 0.0 8.051285322346114 0.0 0.0 0.0 0.0 0.0 8.527275891473515 0.0 0.0 0.0 C C 0.0 0.0 40.256426611730575 0.0 0.0 0.0 0.0 0.0 42.63637945736757 0.0 0.0 0.0 0.89 0.93 156.51541877186926 223.28268772715109 27.7425 24.2425 0 0 12 0 0 0 0 0 13 0 0 0 -0 Cer(d40:4)+H-H2O Cer(d40:4)+H-H2O Cer (d40:4) (d40:4) 598.55575547 C40 H72 O2 N1 2.1016330912E7 1.0441095645E7 8.134 4.422388943464104 4.637673640982519 0.99 9718097.0 0.0 0.0 1.9741783425E7 0.0 0.0 0.0 0.0 0.0 2.1016330912E7 0.0 0.0 0.0 0.0 0.0 1.0441095645E7 0.0 0.0 0.0 0.0 0.0 9778043.26 0.0 0.0 0.0 8.135 8.14 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -790 -789 2293 -788 -787 -786 -785 -784 -783 -782 -781 -780 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 598.555798 598.55576 8.134 8.134 8.135 8.134 8.134 8.134 8.134 8.134 8.14 8.134 8.134 8.134 1.0250161E7 1 1 1 1 1 1 1 1 1 1 1 1 598.55575547 598.55575547 4.252999997333973E-5 598.55575547 598.55575547 598.55575547 598.55575547 598.55575547 4.5299999555936665E-6 598.55575547 598.55575547 598.55575547 1000000.0 1000000.0 0.07105436642229625 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.007568217186445069 1000000.0 1000000.0 1000000.0 0.0 0.0 8.659492363865839 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 43.29746181932919 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 90.99292137115113 9718097.0 7.7776 13.1969 0 0 8 0 0 0 0 0 8 0 0 0 -0 Cer(d18:1_23:0)+H Cer(d41:1)+H Cer (d18:1_23:0) (d18:1) (23:0) 636.62892047 C41 H82 O3 N1 1.7278984179E7 5961252.101 9.130158176359403 12.387738042823624 7.173702469362044 1.0 256.53425163208067 0.0 0.0 1.4495695835E7 0.0 0.0 0.0 0.0 0.0 1.7278984179E7 0.0 0.0 0.0 0.0 0.0 5385671.065 0.0 0.0 0.0 0.0 0.0 5961252.101 0.0 0.0 0.0 9.128 9.133 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -800 -799 2730 -798 -797 -796 -795 -794 2811 -793 -792 -791 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 636.628711 636.629141 9.130158176359403 9.130158176359403 9.128 9.130158176359403 9.130158176359403 9.130158176359403 9.130158176359403 9.130158176359403 9.133 9.130158176359403 9.130158176359403 9.130158176359403 4629518.5 5340109.5 1 1 1 1 1 1 1 1 1 1 1 1 636.62892047 636.62892047 2.0947000007254246E-4 636.62892047 636.62892047 636.62892047 636.62892047 636.62892047 2.2052999997868028E-4 636.62892047 636.62892047 636.62892047 1000000.0 1000000.0 0.3290299785908224 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.346402736174585 1000000.0 1000000.0 1000000.0 0.0 0.0 10.44557464597227 0.0 0.0 0.0 0.0 0.0 11.896213255376145 0.0 0.0 0.0 B B 0.0 0.0 26.113936614930676 0.0 0.0 0.0 0.0 0.0 29.740533138440362 0.0 0.0 0.0 0.99 1.0 99.80229875355224 256.53425163208067 10.5804 7.4525 0 0 10 0 0 0 0 0 11 0 0 0 -0 Cer(d41:1)+H-H2O Cer(d41:1)+H-H2O Cer (d18:1_23:0) (d18:1) (23:0) 618.61835547 C41 H80 O2 N1 2.8473448825E7 9977876.395 9.130158176359403 9.959521220249702 14.373293833330086 0.99 232.29341459849016 0.0 0.0 2.4726847239E7 0.0 0.0 0.0 0.0 0.0 2.8473448825E7 0.0 0.0 0.0 0.0 0.0 8136799.706 0.0 0.0 0.0 0.0 0.0 9977876.395 0.0 0.0 0.0 9.129 9.13 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 1.0 -811 -810 2726 -809 -808 -807 -806 -805 -804 -803 -802 -801 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 618.618106 618.61836 9.130158176359403 9.130158176359403 9.129 9.130158176359403 9.130158176359403 9.130158176359403 9.130158176359403 9.130158176359403 9.13 9.130158176359403 9.130158176359403 9.130158176359403 6196909.0 1 1 1 1 1 1 1 1 1 1 1 1 618.61835547 618.61835547 2.4946999997155217E-4 618.61835547 618.61835547 618.61835547 618.61835547 618.61835547 4.530000069280504E-6 618.61835547 618.61835547 618.61835547 1000000.0 1000000.0 0.40326963751668093 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.007322770217250994 1000000.0 1000000.0 1000000.0 0.0 0.0 5.662825999450834 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 28.314129997254167 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 506.2563222381629 232.29341459849016 7.2579 8.1611 0 0 12 0 0 0 0 0 11 0 0 0 -0 Cer(d18:1_24:0)+H Cer(d42:1)+H Cer (d18:1_24:0) (d18:1) (24:0) 650.6445704700001 C42 H84 O3 N1 2.1062618631E7 8536508.653 9.261709817066855 13.521345414089778 11.79503721653448 0.99 8570448.0 0.0 0.0 1.7386486244E7 0.0 0.0 0.0 0.0 0.0 2.1062618631E7 0.0 0.0 0.0 0.0 0.0 7222178.835 0.0 0.0 0.0 0.0 0.0 8536508.653 0.0 0.0 0.0 9.258 9.263 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -821 -820 2791 -819 -818 -817 -816 -815 2870 -814 -813 -812 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 650.644588 650.644601 9.261709817066855 9.261709817066855 9.258 9.261709817066855 9.261709817066855 9.261709817066855 9.261709817066855 9.261709817066855 9.263 9.261709817066855 9.261709817066855 9.261709817066855 7224408.5 7383801.5 1 1 1 1 1 1 1 1 1 1 1 1 650.6445704700001 650.6445704700001 1.7529999922771822E-5 650.6445704700001 650.6445704700001 650.6445704700001 650.6445704700001 650.6445704700001 3.052999988994998E-5 650.6445704700001 650.6445704700001 650.6445704700001 1000000.0 1000000.0 0.02694251319135552 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.046922699851158836 1000000.0 1000000.0 1000000.0 0.0 0.0 12.036689609491557 0.0 0.0 0.0 0.0 0.0 17.65320399306579 0.0 0.0 0.0 B B 0.0 0.0 30.09172402372889 0.0 0.0 0.0 0.0 0.0 44.13300998266448 0.0 0.0 0.0 0.99 0.99 88.90611169537509 8570448.0 7.9338 9.1345 0 0 9 0 0 0 0 0 9 0 0 0 -0 Cer(d42:1)+H-H2O Cer(d42:1)+H-H2O Cer (d18:1_24:0) (d18:1) (24:0) 632.63400547 C42 H82 O2 N1 3.1379691209E7 1.0698693626E7 9.261709817066855 6.4878676237851725 0.6636735307621617 0.99 164.16889352724073 0.0 0.0 2.8626823236E7 0.0 0.0 0.0 0.0 0.0 3.1379691209E7 0.0 0.0 0.0 0.0 0.0 1.0698693626E7 0.0 0.0 0.0 0.0 0.0 1.059874728E7 0.0 0.0 0.0 9.256 9.264 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 1.0 0.97 -831 -830 2782 -829 -828 -827 -826 -825 2862 -824 -823 -822 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 632.633954 632.634223 9.261709817066855 9.261709817066855 9.256 9.261709817066855 9.261709817066855 9.261709817066855 9.261709817066855 9.261709817066855 9.264 9.261709817066855 9.261709817066855 9.261709817066855 7522076.0 2486265.5 1 1 1 1 1 1 1 1 1 1 1 1 632.63400547 632.63400547 5.147000001670676E-5 632.63400547 632.63400547 632.63400547 632.63400547 632.63400547 2.1752999998625455E-4 632.63400547 632.63400547 632.63400547 1000000.0 1000000.0 0.08135825702013659 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3438480987512613 1000000.0 1000000.0 1000000.0 0.0 0.0 8.135492960002919 0.0 0.0 0.0 0.0 0.0 8.123098968741228 0.0 0.0 0.0 C C 0.0 0.0 40.6774648000146 0.0 0.0 0.0 0.0 0.0 40.615494843706145 0.0 0.0 0.0 0.98 0.99 98.16680778751795 164.16889352724073 14.5398 14.3668 0 0 9 0 0 0 0 0 10 0 0 0 -0 ChE()+H-H2O ChE()+H-H2O ChE () 369.35157647 C27 H45 O0 1835516.102 882826.626 9.813967006388948 15.145791078605896 21.736222843629466 0.98 22.133903502726188 0.0 0.0 0.0 1835516.102 0.0 0.0 0.0 0.0 0.0 1480392.516 0.0 0.0 0.0 0.0 0.0 882826.626 0.0 0.0 0.0 0.0 0.0 647602.294 0.0 0.0 9.815 9.809 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -957 -956 -955 776 -954 -953 -952 -951 -950 822 -949 -948 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 369.351822 369.351787 9.813967006388948 9.813967006388948 9.813967006388948 9.815 9.813967006388948 9.813967006388948 9.813967006388948 9.813967006388948 9.813967006388948 9.809 9.813967006388948 9.813967006388948 351169.53125 419698.4375 1 1 1 1 1 1 1 1 1 1 1 1 369.35157647 369.35157647 369.35157647 2.455300000292482E-4 369.35157647 369.35157647 369.35157647 369.35157647 369.35157647 2.1053000000392785E-4 369.35157647 369.35157647 1000000.0 1000000.0 1000000.0 0.6647595832021336 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5699989208548236 1000000.0 1000000.0 0.0 0.0 0.0 9.923546918496886 0.0 0.0 0.0 0.0 0.0 8.125014730944047 0.0 0.0 C C 0.0 0.0 0.0 52.22919430787832 0.0 0.0 0.0 0.0 0.0 54.16676487296031 0.0 0.0 0.98 1.0 22.133903502726188 23.001104194538737 12.1067 10.5294 0 0 0 14 0 0 0 0 0 16 0 0 -0 ChE()+H-H2O ChE()+H-H2O ChE () 369.35157647 C27 H45 O0 587383.934 354103.285 10.0 5.896710613452916 37.30373265401076 0.83 13.9704909301349 0.0 0.0 0.0 587383.934 0.0 0.0 0.0 0.0 0.0 540361.418 0.0 0.0 0.0 0.0 0.0 354103.285 0.0 0.0 0.0 0.0 0.0 206285.49 0.0 0.0 10.0 9.999 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -968 -967 -966 789 -965 -964 -963 -962 -961 -960 -959 -958 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 369.351917 369.35158 10.0 10.0 10.0 10.0 10.0 10.0 10.0 10.0 10.0 9.999 10.0 10.0 120954.695313 1 1 1 1 1 1 1 1 1 1 1 1 369.35157647 369.35157647 369.35157647 3.405300000167699E-4 369.35157647 369.35157647 369.35157647 369.35157647 369.35157647 3.5300000149618427E-6 369.35157647 369.35157647 1000000.0 1000000.0 1000000.0 0.9219670950678315 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.009557289693194424 1000000.0 1000000.0 0.0 0.0 0.0 8.166622082661474 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 54.44414721774316 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 0.89 13.9704909301349 5.12971036047482 3.3354 3.3807 0 0 0 20 0 0 0 0 0 23 0 0 -0 CmE()+H-H2O CmE()+H-H2O CmE () 383.36722647 C28 H47 O0 9857245.299 4761920.632 7.393041836832763 3.4992054917108892 5.932524496126233 0.99 444.88430897403083 0.0 0.0 0.0 9857245.299 0.0 0.0 0.0 0.0 0.0 9381225.52 0.0 0.0 0.0 0.0 0.0 4761920.632 0.0 0.0 0.0 0.0 0.0 4378487.082 0.0 0.0 7.395 7.392 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -978 -977 -976 658 -975 -974 -973 -972 -971 706 -970 -969 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 383.367464 383.367325 7.393041836832763 7.393041836832763 7.393041836832763 7.395 7.393041836832763 7.393041836832763 7.393041836832763 7.393041836832763 7.393041836832763 7.392 7.393041836832763 7.393041836832763 739779.6875 1364087.5 1 1 1 1 1 1 1 1 1 1 1 1 383.36722647 383.36722647 383.36722647 2.3752999999260282E-4 383.36722647 383.36722647 383.36722647 383.36722647 383.36722647 9.853000000248358E-5 383.36722647 383.36722647 1000000.0 1000000.0 1000000.0 0.6195886961432538 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.25701205841129443 1000000.0 1000000.0 0.0 0.0 0.0 9.946522240058966 0.0 0.0 0.0 0.0 0.0 11.3528483837448 0.0 0.0 C C 0.0 0.0 0.0 47.364391619328394 0.0 0.0 0.0 0.0 0.0 51.603856289749075 0.0 0.0 0.99 0.98 444.88430897403083 465.0895607895806 63.5242 60.4236 0 0 0 10 0 0 0 0 0 10 0 0 -0 Co(Q10)+H Co(Q10)+H Co (Q10) (Q10) 863.69118647 C59 H91 O4 1.82493096895E8 7.170662569E7 9.576 3.3471371194509074 4.001188304933423 1.0 996.6357171203286 0.0 1.74054390316E8 0.0 0.0 0.0 0.0 0.0 1.82493096895E8 0.0 0.0 0.0 0.0 0.0 6.7760721525E7 0.0 0.0 0.0 0.0 0.0 7.170662569E7 0.0 0.0 0.0 0.0 9.578 9.579 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.94 0.93 -989 -988 -987 -986 -985 -984 -983 853 -982 -981 -980 -979 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 863.69119 863.690664 9.576 9.578 9.576 9.576 9.576 9.576 9.576 9.579 9.576 9.576 9.576 9.576 2.6027618E7 1 1 1 1 1 1 1 1 1 1 1 1 863.69118647 3.529999958118424E-6 863.69118647 863.69118647 863.69118647 863.69118647 863.69118647 5.224700000781013E-4 863.69118647 863.69118647 863.69118647 863.69118647 1000000.0 0.004087108926682369 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6049268630533248 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.059102399730182 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 42.416328419632535 0.0 0.0 0.0 0.0 1.0 1.0 47.55900491238397 996.6357171203286 25.9212 40.8465 0 10 0 0 0 0 0 8 0 0 0 0 -0 Co(Q8)+H Co(Q8)+H Co (Q8) (Q8) 727.5659864700001 C49 H75 O4 9918834.765 4916066.885 8.817 3.5992814917790015 2.8461210884930943 0.99 96.90291122661083 0.0 0.0 9426481.691 0.0 0.0 0.0 0.0 0.0 9918834.765 0.0 0.0 0.0 0.0 0.0 4722097.712 0.0 0.0 0.0 0.0 0.0 4916066.885 0.0 0.0 0.0 8.814 8.824 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1000 -999 2601 -998 -997 -996 -995 -994 -993 -992 -991 -990 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 727.565585 727.56599 8.817 8.817 8.814 8.817 8.817 8.817 8.817 8.817 8.824 8.817 8.817 8.817 4120149.5 1 1 1 1 1 1 1 1 1 1 1 1 727.5659864700001 727.5659864700001 4.014700000425364E-4 727.5659864700001 727.5659864700001 727.5659864700001 727.5659864700001 727.5659864700001 3.529999958118424E-6 727.5659864700001 727.5659864700001 727.5659864700001 1000000.0 1000000.0 0.5517987474790925 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004851793546926587 1000000.0 1000000.0 1000000.0 0.0 0.0 7.409995412570209 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 41.16664118094561 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 4611730.5 96.90291122661083 9.2838 12.6064 0 0 7 0 0 0 0 0 7 0 0 0 -0 DG(16:0_14:0)+Na DG(30:0)+Na DG (16:0_14:0) (16:0) (14:0) 563.4645964700002 C33 H64 O5 Na1 2.0292831585E7 6687969.903 7.707 19.046043732158843 8.299792292464232 0.92 5941096.5 0.0 0.0 2.0292831585E7 0.0 0.0 0.0 0.0 0.0 1.5475676725E7 0.0 0.0 0.0 0.0 0.0 5946474.642 0.0 0.0 0.0 0.0 0.0 6687969.903 0.0 0.0 0.0 7.703 7.707 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 1.0 0.9 -1022 -1021 -1020 -1019 -1018 -1017 -1016 -1015 2188 -1014 -1013 -1012 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 563.4646 563.466585 7.707 7.707 7.703 7.707 7.707 7.707 7.707 7.707 7.707 7.707 7.707 7.707 8573223.0 1 1 1 1 1 1 1 1 1 1 1 1 563.4645964700002 563.4645964700002 3.529999844431586E-6 563.4645964700002 563.4645964700002 563.4645964700002 563.4645964700002 563.4645964700002 0.0019885299998350092 563.4645964700002 563.4645964700002 563.4645964700002 1000000.0 1000000.0 0.006264812140010875 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.5291125871843168 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.193184185809336 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 45.98685063567776 0.0 0.0 0.0 0.92 0.99 5941096.5 8573223.0 9.3407 5.4959 0 0 15 0 0 0 0 0 10 0 0 0 -0 DG(32:2e)+Na DG(32:2e)+Na DG (32:2e) (32:2e) 573.48533147 C35 H66 O4 Na1 3.0573574868E7 1.1727842999E7 8.052 3.5950663105265424 4.485694763084588 0.99 47.89514166516531 0.0 0.0 3.0573574868E7 0.0 0.0 0.0 0.0 0.0 2.9057690983E7 0.0 0.0 0.0 0.0 0.0 1.1727842999E7 0.0 0.0 0.0 0.0 0.0 1.1006732901E7 0.0 0.0 0.0 8.055 8.051 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1033 -1032 -1031 -1030 -1029 -1028 -1027 -1026 2354 -1025 -1024 -1023 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 573.48533 573.487593 8.052 8.052 8.055 8.052 8.052 8.052 8.052 8.052 8.051 8.052 8.052 8.052 1.0421539E7 1 1 1 1 1 1 1 1 1 1 1 1 573.48533147 573.48533147 1.4700000292577897E-6 573.48533147 573.48533147 573.48533147 573.48533147 573.48533147 0.0022615299999415583 573.48533147 573.48533147 573.48533147 1000000.0 1000000.0 0.0025632739820733983 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.9434836007830176 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.53979413913765 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 40.55981352796534 0.0 0.0 0.0 0.99 0.99 47.89514166516531 21.896936004917205 14.7429 14.5003 0 0 14 0 0 0 0 0 13 0 0 0 -0 DG(14:0_18:3)+Na DG(32:3)+Na DG (14:0_18:3) (14:0) (18:3) 585.4489464700001 C35 H62 O5 Na1 7.2768912254E7 3.2437694861E7 7.01 2.5003869588118617 9.43022595975853 1.0 3.1299996E7 0.0 0.0 7.0240448727E7 0.0 0.0 0.0 0.0 0.0 7.2768912254E7 0.0 0.0 0.0 0.0 0.0 2.838212199E7 0.0 0.0 0.0 0.0 0.0 3.2437694861E7 0.0 0.0 0.0 7.013 7.012 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1044 -1043 1759 -1042 -1041 -1040 -1039 -1038 -1037 -1036 -1035 -1034 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 585.451325 585.44895 7.01 7.01 7.013 7.01 7.01 7.01 7.01 7.01 7.012 7.01 7.01 7.01 7770197.5 1 1 1 1 1 1 1 1 1 1 1 1 585.4489464700001 585.4489464700001 0.0023785299998735354 585.4489464700001 585.4489464700001 585.4489464700001 585.4489464700001 585.4489464700001 3.529999844431586E-6 585.4489464700001 585.4489464700001 585.4489464700001 1000000.0 1000000.0 4.062745375519123 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0060295605034665 1000000.0 1000000.0 1000000.0 0.0 0.0 11.93503563200883 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 38.67030074121347 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 252.86240254491642 3.1299996E7 15.5839 17.4502 0 0 10 0 0 0 0 0 10 0 0 0 -0 DG(14:0_18:3)+NH4 DG(32:3)+NH4 DG (14:0_18:3) (14:0) (18:3) 580.4935504700001 C35 H66 O5 N1 1.5885098938E7 6512349.0 7.649154086143579 9.995215781626698 16.71074919256409 0.91 29.902495200853686 0.0 0.0 1.5885098938E7 0.0 0.0 0.0 0.0 0.0 1.3787904562500035E7 0.0 0.0 0.0 0.0 0.0 5135952.594 0.0 0.0 0.0 0.0 0.0 6512349.0 0.0 0.0 0.0 7.649 7.65 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -1054 -1053 2066 -1052 -1051 -1050 -1049 -1048 2159 -1047 -1046 -1045 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 580.493343 580.493029 7.649154086143579 7.649154086143579 7.649 7.649154086143579 7.649154086143579 7.649154086143579 7.649154086143579 7.649154086143579 7.65 7.649154086143579 7.649154086143579 7.649154086143579 4954258.5 5505343.0 1 1 1 1 1 1 1 1 1 1 1 1 580.4935504700001 580.4935504700001 2.0747000007759198E-4 580.4935504700001 580.4935504700001 580.4935504700001 580.4935504700001 580.4935504700001 5.21470000080626E-4 580.4935504700001 580.4935504700001 580.4935504700001 1000000.0 1000000.0 0.3574027651291089 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.898321780936954 1000000.0 1000000.0 1000000.0 0.0 0.0 27.92416930374217 0.0 0.0 0.0 0.0 0.0 26.201507997915478 0.0 0.0 0.0 A A 0.0 0.0 55.44744348675206 0.0 0.0 0.0 0.0 0.0 51.72495574334734 0.0 0.0 0.0 0.91 0.9939810188681438 29.902495200853686 0.0 10.3769 7.5215 0 0 8 0 0 0 0 0 6 0 0 0 -0 DG(14:0_18:3)+H DG(32:3)+H DG (14:0_18:3) (14:0) (18:3) 563.4670014700001 C35 H63 O5 2.0396561946E7 6640446.738 7.649154086143579 16.772436266305508 7.775868944887539 0.92 5941096.5 0.0 0.0 2.0396561946E7 0.0 0.0 0.0 0.0 0.0 1.6071486608E7 0.0 0.0 0.0 0.0 0.0 5948272.423 0.0 0.0 0.0 0.0 0.0 6640446.738 0.0 0.0 0.0 7.703 7.709 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 1.0 0.93 -1065 -1064 2074 -1063 -1062 -1061 -1060 -1059 -1058 -1057 -1056 -1055 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 563.466411 563.467 7.649154086143579 7.649154086143579 7.703 7.649154086143579 7.649154086143579 7.649154086143579 7.649154086143579 7.649154086143579 7.709 7.649154086143579 7.649154086143579 7.649154086143579 1866523.0 1 1 1 1 1 1 1 1 1 1 1 1 563.4670014700001 563.4670014700001 5.904700001337915E-4 563.4670014700001 563.4670014700001 563.4670014700001 563.4670014700001 563.4670014700001 1.4700001429446274E-6 563.4670014700001 563.4670014700001 563.4670014700001 1000000.0 1000000.0 1.0479229459637291 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0026088486798865234 1000000.0 1000000.0 1000000.0 0.0 0.0 21.56622989007881 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 52.94637247760653 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.97 5941096.5 8573223.0 8.867 5.3374 0 0 15 0 0 0 0 0 15 0 0 0 -0 DG(15:0_18:3)+NH4 DG(33:3)+NH4 DG (15:0_18:3) (15:0) (18:3) 594.5092004700001 C36 H68 O5 N1 7588446.598 3662746.047 7.851450001469029 12.806670806342332 27.469798284813514 0.9 1.8242765541991355 0.0 0.0 6328199.166 0.0 0.0 0.0 0.0 0.0 7588446.598 0.0 0.0 0.0 0.0 0.0 2471269.852 0.0 0.0 0.0 0.0 0.0 3662746.047 0.0 0.0 0.0 7.855 7.851 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -1075 -1074 2163 -1073 -1072 -1071 -1070 -1069 2259 -1068 -1067 -1066 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 594.509181 594.508732 7.851450001469029 7.851450001469029 7.855 7.851450001469029 7.851450001469029 7.851450001469029 7.851450001469029 7.851450001469029 7.851 7.851450001469029 7.851450001469029 7.851450001469029 2645471.5 3036815.75 1 1 1 1 1 1 1 1 1 1 1 1 594.5092004700001 594.5092004700001 1.9470000097498996E-5 594.5092004700001 594.5092004700001 594.5092004700001 594.5092004700001 594.5092004700001 4.6847000010075135E-4 594.5092004700001 594.5092004700001 594.5092004700001 1000000.0 1000000.0 0.03274970359097325 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7879945335251226 1000000.0 1000000.0 1000000.0 0.0 0.0 23.76290438372938 0.0 0.0 0.0 0.0 0.0 18.77858750309888 0.0 0.0 0.0 B B 0.0 0.0 58.92193543491998 0.0 0.0 0.0 0.0 0.0 47.129400375137266 0.0 0.0 0.0 0.98 0.9 8.697239652946106 1.8242765541991355 3.3739 3.422 0 0 11 0 0 0 0 0 8 0 0 0 -0 DG(16:0_18:1)+NH4 DG(34:1)+NH4 DG (16:0_18:1) (16:0) (18:1) 612.55615047 C37 H74 O5 N1 1.3878622226E7 5437312.112 8.608 5.470109243313175 4.379253019268852 0.99 399.23691630589076 0.0 0.0 1.2844966806E7 0.0 0.0 0.0 0.0 0.0 1.3878622226E7 0.0 0.0 0.0 0.0 0.0 5110682.949 0.0 0.0 0.0 0.0 0.0 5437312.112 0.0 0.0 0.0 8.606 8.61 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.95 0.93 -1086 -1085 2501 -1084 -1083 -1082 -1081 -1080 -1079 -1078 -1077 -1076 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 612.556256 612.55615 8.608 8.608 8.606 8.608 8.608 8.608 8.608 8.608 8.61 8.608 8.608 8.608 6098527.5 1 1 1 1 1 1 1 1 1 1 1 1 612.55615047 612.55615047 1.0552999992796686E-4 612.55615047 612.55615047 612.55615047 612.55615047 612.55615047 4.70000031782547E-7 612.55615047 612.55615047 612.55615047 1000000.0 1000000.0 0.17227808397156105 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.672766511640231E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 5.446909054493144 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 54.973514371842136 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 97.91635680893307 399.23691630589076 8.295 14.2813 0 0 9 0 0 0 0 0 10 0 0 0 -0 DG(16:0_18:2)+NH4 DG(34:2)+NH4 DG (16:0_18:2) (16:0) (18:2) 610.54050047 C37 H72 O5 N1 5.1186694702E7 2.0397708702E7 8.329539523617942 3.0453094460972636 0.6099541831371784 0.99 2.4830568E7 0.0 0.0 4.9028697573E7 0.0 0.0 0.0 0.0 0.0 5.1186694702E7 0.0 0.0 0.0 0.0 0.0 2.0222512575E7 0.0 0.0 0.0 0.0 0.0 2.0397708702E7 0.0 0.0 0.0 8.329 8.332 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.93 0.92 -1096 -1095 2370 -1094 -1093 -1092 -1091 -1090 2457 -1089 -1088 -1087 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 610.54044 610.540224 8.329539523617942 8.329539523617942 8.329 8.329539523617942 8.329539523617942 8.329539523617942 8.329539523617942 8.329539523617942 8.332 8.329539523617942 8.329539523617942 8.329539523617942 2974940.25 5103010.5 1 1 1 1 1 1 1 1 1 1 1 1 610.54050047 610.54050047 6.046999999398395E-5 610.54050047 610.54050047 610.54050047 610.54050047 610.54050047 2.7647000001707056E-4 610.54050047 610.54050047 610.54050047 1000000.0 1000000.0 0.09904338851793379 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.45282827233286127 1000000.0 1000000.0 1000000.0 0.0 0.0 21.271034105433625 0.0 0.0 0.0 0.0 0.0 22.534673912992172 0.0 0.0 0.0 B B 0.0 0.0 52.61667047424387 0.0 0.0 0.0 0.0 0.0 56.14637873507052 0.0 0.0 0.0 1.0 0.99 464.6561026115126 2.4830568E7 27.7688 16.979 0 0 11 0 0 0 0 0 11 0 0 0 -0 DG(16:0_18:3)+H DG(34:3)+H DG (16:0_18:3) (16:0) (18:3) 591.49830147 C37 H67 O5 8.7233271139E7 3.8569418598E7 8.053519267945722 3.7128142370088435 6.882818486840976 0.99 3.8036232E7 0.0 0.0 8.7233271139E7 0.0 0.0 0.0 0.0 0.0 8.2770077806E7 0.0 0.0 0.0 0.0 0.0 3.8569418598E7 0.0 0.0 0.0 0.0 0.0 3.4989393857E7 0.0 0.0 0.0 8.055 8.058 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 1.0 0.89 -1106 -1105 2246 -1104 -1103 -1102 -1101 -1100 2345 -1099 -1098 -1097 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 591.498451 591.49846 8.053519267945722 8.053519267945722 8.055 8.053519267945722 8.053519267945722 8.053519267945722 8.053519267945722 8.053519267945722 8.058 8.053519267945722 8.053519267945722 8.053519267945722 2.1932844E7 1.9953776E7 1 1 1 1 1 1 1 1 1 1 1 1 591.49830147 591.49830147 1.495300000442512E-4 591.49830147 591.49830147 591.49830147 591.49830147 591.49830147 1.585300000215284E-4 591.49830147 591.49830147 591.49830147 1000000.0 1000000.0 0.25279869726191456 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.26801429459314996 1000000.0 1000000.0 1000000.0 0.0 0.0 21.063403071851152 0.0 0.0 0.0 0.0 0.0 21.750529628639384 0.0 0.0 0.0 B B 0.0 0.0 51.4632879219155 0.0 0.0 0.0 0.0 0.0 53.01467494687259 0.0 0.0 0.0 0.99 0.99 3.8036232E7 771.4616832616609 18.4349 31.9322 0 0 10 0 0 0 0 0 12 0 0 0 -0 DG(16:0_18:3)+NH4 DG(34:3)+NH4 DG (16:0_18:3) (16:0) (18:3) 608.5248504699999 C37 H70 O5 N1 2.58650443518E8 1.07887347937E8 8.053519267945722 0.5266154622561178 5.457757965018302 0.99 213.29951417002476 0.0 0.0 2.58650443518E8 0.0 0.0 0.0 0.0 0.0 2.56731299183E8 0.0 0.0 0.0 0.0 0.0 1.07887347937E8 0.0 0.0 0.0 0.0 0.0 9.9869556766E7 0.0 0.0 0.0 8.052 8.054 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.88 0.9 -1116 -1115 2232 -1114 -1113 -1112 -1111 -1110 2331 -1109 -1108 -1107 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 608.524847 608.524916 8.053519267945722 8.053519267945722 8.052 8.053519267945722 8.053519267945722 8.053519267945722 8.053519267945722 8.053519267945722 8.054 8.053519267945722 8.053519267945722 8.053519267945722 4235356.0 3980335.75 1 1 1 1 1 1 1 1 1 1 1 1 608.5248504699999 608.5248504699999 3.4699999105214374E-6 608.5248504699999 608.5248504699999 608.5248504699999 608.5248504699999 608.5248504699999 6.553000002895715E-5 608.5248504699999 608.5248504699999 608.5248504699999 1000000.0 1000000.0 0.0057023142240474655 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10768664579325632 1000000.0 1000000.0 1000000.0 0.0 0.0 19.69630196219559 0.0 0.0 0.0 0.0 0.0 19.379275247594578 0.0 0.0 0.0 B B 0.0 0.0 49.07441900067446 0.0 0.0 0.0 0.0 0.0 48.16818125110186 0.0 0.0 0.0 0.99 0.98 213.29951417002476 967.9769055522924 56.6397 41.8034 0 0 13 0 0 0 0 0 13 0 0 0 -0 DG(16:0_18:3)+H DG(34:3)+H DG (16:0_18:3) (16:0) (18:3) 591.49830147 C37 H67 O5 1320030.354 515574.609 10.203 5.905237657128555 4.253592638810043 1.0 2.809153574523086 0.0 0.0 1214209.772 0.0 0.0 0.0 0.0 0.0 1320030.354 0.0 0.0 0.0 0.0 0.0 485465.872 0.0 0.0 0.0 0.0 0.0 515574.609 0.0 0.0 0.0 10.195 10.204 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1127 -1126 -1125 -1124 -1123 -1122 -1121 -1120 3254 -1119 -1118 -1117 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 591.4983 591.498632 10.203 10.203 10.195 10.203 10.203 10.203 10.203 10.203 10.204 10.203 10.203 10.203 379316.65625 1 1 1 1 1 1 1 1 1 1 1 1 591.49830147 591.49830147 1.4700000292577897E-6 591.49830147 591.49830147 591.49830147 591.49830147 591.49830147 3.305300000420175E-4 591.49830147 591.49830147 591.49830147 1000000.0 1000000.0 0.0024852142865068668 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5588012665811206 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.43564111148248 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 37.98406252460796 0.0 0.0 0.0 0.99 1.0 7.944225811475076 2.809153574523086 7.5228 7.6733 0 0 12 0 0 0 0 0 10 0 0 0 -0 DG(16:1_18:3)+NH4 DG(34:4)+NH4 DG (16:1_18:3) (16:1) (18:3) 606.5092004700001 C37 H68 O5 N1 7.990006609E7 1.5049421541E7 7.707893969422419 9.689660371702926 0.8782008177132521 0.97 51.08871657245732 0.0 0.0 6.9653235363E7 0.0 0.0 0.0 0.0 0.0 7.990006609E7 0.0 0.0 0.0 0.0 0.0 1.4863666721E7 0.0 0.0 0.0 0.0 0.0 1.5049421541E7 0.0 0.0 0.0 7.729 7.715 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 1.0 0.82 -1137 -1136 2082 -1135 -1134 -1133 -1132 -1131 2175 -1130 -1129 -1128 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 606.509605 606.50941 7.707893969422419 7.707893969422419 7.729 7.707893969422419 7.707893969422419 7.707893969422419 7.707893969422419 7.707893969422419 7.715 7.707893969422419 7.707893969422419 7.707893969422419 8133013.5 9530328.0 1 1 1 1 1 1 1 1 1 1 1 1 606.5092004700001 606.5092004700001 4.0452999985518545E-4 606.5092004700001 606.5092004700001 606.5092004700001 606.5092004700001 606.5092004700001 2.0952999989276577E-4 606.5092004700001 606.5092004700001 606.5092004700001 1000000.0 1000000.0 0.6669808133853607 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.34546879046582546 1000000.0 1000000.0 1000000.0 0.0 0.0 28.34307228642319 0.0 0.0 0.0 0.0 0.0 16.104681869221643 0.0 0.0 0.0 A B 0.0 0.0 55.95266347884894 0.0 0.0 0.0 0.0 0.0 52.90458550282641 0.0 0.0 0.0 0.95 0.97 44.02906752710565 51.08871657245732 7.7116 10.9285 0 0 15 0 0 0 0 0 16 0 0 0 -0 DG(16:1_18:3)+H DG(34:4)+H DG (16:1_18:3) (16:1) (18:3) 589.4826514700002 C37 H65 O5 1.9391825719E7 4452551.233 7.707893969422419 3.9211545591390937 2.0947272393536123 0.97 5203431.5 0.0 0.0 1.8345492538E7 0.0 0.0 0.0 0.0 0.0 1.9391825719E7 0.0 0.0 0.0 0.0 0.0 4322574.437 0.0 0.0 0.0 0.0 0.0 4452551.233 0.0 0.0 0.0 7.723 7.716 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 1.0 0.87 -1147 -1146 2108 -1145 -1144 -1143 -1142 -1141 2182 -1140 -1139 -1138 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 589.482431 589.483267 7.707893969422419 7.707893969422419 7.723 7.707893969422419 7.707893969422419 7.707893969422419 7.707893969422419 7.707893969422419 7.716 7.707893969422419 7.707893969422419 7.707893969422419 3699734.5 3242944.0 1 1 1 1 1 1 1 1 1 1 1 1 589.4826514700002 589.4826514700002 2.2047000015845697E-4 589.4826514700002 589.4826514700002 589.4826514700002 589.4826514700002 589.4826514700002 6.15529999777209E-4 589.4826514700002 589.4826514700002 589.4826514700002 1000000.0 1000000.0 0.374005917915766 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0441867936948683 1000000.0 1000000.0 1000000.0 0.0 0.0 13.351642133567442 0.0 0.0 0.0 0.0 0.0 22.39414170332844 0.0 0.0 0.0 B B 0.0 0.0 43.21826783715565 0.0 0.0 0.0 0.0 0.0 54.71462319318763 0.0 0.0 0.0 0.88 0.97 6.558724984860896 5203431.5 4.6436 4.0577 0 0 14 0 0 0 0 0 15 0 0 0 -0 DG(17:0_18:3)+NH4 DG(35:3)+NH4 DG (17:0_18:3) (17:0) (18:3) 622.54050047 C38 H72 O5 N1 1.2142353252E7 5506061.938 8.236486115446771 0.07125100891786101 0.33017235967871245 0.97 17.74194374176601 0.0 0.0 1.2130124275E7 0.0 0.0 0.0 0.0 0.0 1.2142353252E7 0.0 0.0 0.0 0.0 0.0 5506061.938 0.0 0.0 0.0 0.0 0.0 5480412.134 0.0 0.0 0.0 8.237 8.235 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1157 -1156 2334 -1155 -1154 -1153 -1152 -1151 2431 -1150 -1149 -1148 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 622.540148 622.540346 8.236486115446771 8.236486115446771 8.237 8.236486115446771 8.236486115446771 8.236486115446771 8.236486115446771 8.236486115446771 8.235 8.236486115446771 8.236486115446771 8.236486115446771 5448544.0 4242862.5 1 1 1 1 1 1 1 1 1 1 1 1 622.54050047 622.54050047 3.5246999993887584E-4 622.54050047 622.54050047 622.54050047 622.54050047 622.54050047 1.5446999998403044E-4 622.54050047 622.54050047 622.54050047 1000000.0 1000000.0 0.5661800311349562 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.24812843480449878 1000000.0 1000000.0 1000000.0 0.0 0.0 23.45127290563189 0.0 0.0 0.0 0.0 0.0 13.97858185716523 0.0 0.0 0.0 B B 0.0 0.0 58.57161283432494 0.0 0.0 0.0 0.0 0.0 46.51277322071044 0.0 0.0 0.0 0.96 0.97 22.12153531814147 17.74194374176601 4.2737 3.8921 0 0 7 0 0 0 0 0 7 0 0 0 -0 DG(17:1_18:3)+NH4 DG(35:4)+NH4 DG (17:1_18:3) (17:1) (18:3) 620.5248504699999 C38 H70 O5 N1 7234522.539 2720413.542 7.893 12.872604525368589 2.362439002780953 0.97 3113053.5 0.0 0.0 6027383.295 0.0 0.0 0.0 0.0 0.0 7234522.539 0.0 0.0 0.0 0.0 0.0 2631018.057 0.0 0.0 0.0 0.0 0.0 2720413.542 0.0 0.0 0.0 7.892 7.891 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.94 0.96 -1168 -1167 2185 -1166 -1165 -1164 -1163 -1162 -1161 -1160 -1159 -1158 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 620.524658 620.52485 7.893 7.893 7.892 7.893 7.893 7.893 7.893 7.893 7.891 7.893 7.893 7.893 2366316.25 1 1 1 1 1 1 1 1 1 1 1 1 620.5248504699999 620.5248504699999 1.9246999988808966E-4 620.5248504699999 620.5248504699999 620.5248504699999 620.5248504699999 620.5248504699999 4.699999180957093E-7 620.5248504699999 620.5248504699999 620.5248504699999 1000000.0 1000000.0 0.3101729120796829 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.574232002791193E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 21.87349579437879 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 54.7635754445371 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.97 3377520.75 3113053.5 3.9942 4.517 0 0 10 0 0 0 0 0 9 0 0 0 -0 DG(18:1_18:1)+H DG(36:2)+H DG (18:1_18:1) (18:1) (18:1) 621.5452514700002 C39 H73 O5 3419128.067 858668.022 8.651200047752516 22.42958403439495 4.190331438695229 0.97 990614.63 0.0 0.0 2483037.982 0.0 0.0 0.0 0.0 0.0 3419128.067 0.0 0.0 0.0 0.0 0.0 809247.489 0.0 0.0 0.0 0.0 0.0 858668.022 0.0 0.0 0.0 8.616 8.639 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 1.0 0.9 -1179 -1178 -1177 -1176 -1175 -1174 -1173 -1172 2587 -1171 -1170 -1169 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 621.54525 621.545428 8.651200047752516 8.651200047752516 8.616 8.651200047752516 8.651200047752516 8.651200047752516 8.651200047752516 8.651200047752516 8.639 8.651200047752516 8.651200047752516 8.651200047752516 467133.78125 1 1 1 1 1 1 1 1 1 1 1 1 621.5452514700002 621.5452514700002 1.4700001429446274E-6 621.5452514700002 621.5452514700002 621.5452514700002 621.5452514700002 621.5452514700002 1.7652999986239593E-4 621.5452514700002 621.5452514700002 621.5452514700002 1000000.0 1000000.0 0.0023650734028905682 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2840179366584968 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.69576276832152 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 49.991756358602196 0.0 0.0 0.0 0.69 0.97 2.5323862588454555 990614.63 3.6021 4.136 0 0 12 0 0 0 0 0 11 0 0 0 -0 DG(18:1_18:1)+NH4 DG(36:2)+NH4 DG (18:1_18:1) (18:1) (18:1) 638.5718004700001 C39 H76 O5 N1 6.3395242657E7 1.7410163725E7 8.651200047752516 3.4947562768743423 15.222762664898978 0.97 1.9885714E7 0.0 0.0 6.0337598916E7 0.0 0.0 0.0 0.0 0.0 6.3395242657E7 0.0 0.0 0.0 0.0 0.0 1.4026304922E7 0.0 0.0 0.0 0.0 0.0 1.7410163725E7 0.0 0.0 0.0 8.65 8.65 0.0 0.0 0.045 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.87 0.95 -1190 -1189 -1188 -1187 -1186 -1185 -1184 -1183 2578 -1182 -1181 -1180 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 638.5718 638.572165 8.651200047752516 8.651200047752516 8.65 8.651200047752516 8.651200047752516 8.651200047752516 8.651200047752516 8.651200047752516 8.65 8.651200047752516 8.651200047752516 8.651200047752516 1194331.875 1 1 1 1 1 1 1 1 1 1 1 1 638.5718004700001 638.5718004700001 4.70000031782547E-7 638.5718004700001 638.5718004700001 638.5718004700001 638.5718004700001 638.5718004700001 3.6452999995617574E-4 638.5718004700001 638.5718004700001 638.5718004700001 1000000.0 1000000.0 7.360175182127034E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5708520164652984 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.5968827589103896 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 56.30609155781771 0.0 0.0 0.0 0.86 0.97 1.6258219E7 1.9885714E7 30.5251 18.5269 0 0 12 0 0 0 0 0 13 0 0 0 -0 DG(18:1_18:2)+NH4 DG(36:3)+NH4 DG (18:1_18:2) (18:1) (18:2) 636.55615047 C39 H74 O5 N1 1.03426538799E8 3.1286901491E7 8.355410639371028 11.021261366937948 6.23934652066022 0.86 364.5329348813603 0.0 0.0 1.03426538799E8 0.0 0.0 0.0 0.0 0.0 8.8471522488E7 0.0 0.0 0.0 0.0 0.0 2.8642869378E7 0.0 0.0 0.0 0.0 0.0 3.1286901491E7 0.0 0.0 0.0 8.351 8.362 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.9 0.94 -1200 -1199 2382 -1198 -1197 -1196 -1195 -1194 2469 -1193 -1192 -1191 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 636.557395 636.556046 8.355410639371028 8.355410639371028 8.351 8.355410639371028 8.355410639371028 8.355410639371028 8.355410639371028 8.355410639371028 8.362 8.355410639371028 8.355410639371028 8.355410639371028 8451472.0 9812886.0 1 1 1 1 1 1 1 1 1 1 1 1 636.55615047 636.55615047 0.001244530000008126 636.55615047 636.55615047 636.55615047 636.55615047 636.55615047 1.0446999999658146E-4 636.55615047 636.55615047 636.55615047 1000000.0 1000000.0 1.9550985393656628 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1641174936719192 1000000.0 1000000.0 1000000.0 0.0 0.0 5.782992405600059 0.0 0.0 0.0 0.0 0.0 28.639261416160235 0.0 0.0 0.0 B A 0.0 0.0 57.624322825648534 0.0 0.0 0.0 0.0 0.0 56.64694531635217 0.0 0.0 0.0 0.86 0.95 364.5329348813603 167.45380198988067 17.1243 20.7715 0 0 7 0 0 0 0 0 7 0 0 0 -0 DG(18:1_18:3)+NH4 DG(36:4)+NH4 DG (18:1_18:3) (18:1) (18:3) 634.54050047 C39 H72 O5 N1 3.05251255769E8 1.00641291462E8 8.081906042294971 0.9353770177670578 2.886129912897573 1.0 2319.5072422235758 0.0 0.0 3.01239854232E8 0.0 0.0 0.0 0.0 0.0 3.05251255769E8 0.0 0.0 0.0 0.0 0.0 9.6615667435E7 0.0 0.0 0.0 0.0 0.0 1.00641291462E8 0.0 0.0 0.0 8.08 8.083 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.96 0.97 -1210 -1209 2253 -1208 -1207 -1206 -1205 -1204 2350 -1203 -1202 -1201 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 634.540318 634.540348 8.081906042294971 8.081906042294971 8.08 8.081906042294971 8.081906042294971 8.081906042294971 8.081906042294971 8.081906042294971 8.083 8.081906042294971 8.081906042294971 8.081906042294971 1.9180688E7 2.0781652E7 1 1 1 1 1 1 1 1 1 1 1 1 634.54050047 634.54050047 1.8247000002702407E-4 634.54050047 634.54050047 634.54050047 634.54050047 634.54050047 1.5246999998907995E-4 634.54050047 634.54050047 634.54050047 1000000.0 1000000.0 0.28756241704330887 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.24028411090568125 1000000.0 1000000.0 1000000.0 0.0 0.0 19.679486011416806 0.0 0.0 0.0 0.0 0.0 19.765572685116556 0.0 0.0 0.0 B B 0.0 0.0 48.79678786028638 0.0 0.0 0.0 0.0 0.0 49.12834331855093 0.0 0.0 0.0 1.0 1.0 1586.6281198495954 2319.5072422235758 47.6666 68.4192 0 0 10 0 0 0 0 0 11 0 0 0 -0 DG(18:1_18:3)+H DG(36:4)+H DG (18:1_18:3) (18:1) (18:3) 617.51395147 C39 H69 O5 7.7402376415E7 2.3991778127E7 8.081906042294971 6.302119350604382 1.4191894819592774 1.0 129.14079727261324 0.0 0.0 7.079815847E7 0.0 0.0 0.0 0.0 0.0 7.7402376415E7 0.0 0.0 0.0 0.0 0.0 2.3991778127E7 0.0 0.0 0.0 0.0 0.0 2.3515038431E7 0.0 0.0 0.0 8.081 8.083 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.94 0.95 -1221 -1220 2260 -1219 -1218 -1217 -1216 -1215 -1214 -1213 -1212 -1211 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 617.513497 617.51395 8.081906042294971 8.081906042294971 8.081 8.081906042294971 8.081906042294971 8.081906042294971 8.081906042294971 8.081906042294971 8.083 8.081906042294971 8.081906042294971 8.081906042294971 1.6373231E7 1 1 1 1 1 1 1 1 1 1 1 1 617.51395147 617.51395147 4.544700000224111E-4 617.51395147 617.51395147 617.51395147 617.51395147 617.51395147 1.4700000292577897E-6 617.51395147 617.51395147 617.51395147 1000000.0 1000000.0 0.7359671776492488 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0023805130649411812 1000000.0 1000000.0 1000000.0 0.0 0.0 14.758518941730447 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 47.32011987514703 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 2.6948748E7 129.14079727261324 41.4265 32.2923 0 0 10 0 0 0 0 0 11 0 0 0 -0 DG(18:3_18:2)+H DG(36:5)+H DG (18:3_18:2) (18:3) (18:2) 615.49830147 C39 H67 O5 6.2779149614E7 2.6652362555E7 7.7633800296287925 3.6625737955086892 6.879364544994247 0.99 178.88527909015906 0.0 0.0 6.2779149614E7 0.0 0.0 0.0 0.0 0.0 5.9609490945E7 0.0 0.0 0.0 0.0 0.0 2.6652362555E7 0.0 0.0 0.0 0.0 0.0 2.4179666306E7 0.0 0.0 0.0 7.763 7.768 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.91 0.94 -1231 -1230 2115 -1229 -1228 -1227 -1226 -1225 2208 -1224 -1223 -1222 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 615.498306 615.498463 7.7633800296287925 7.7633800296287925 7.763 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.768 7.7633800296287925 7.7633800296287925 7.7633800296287925 1.6327615E7 1.2318195E7 1 1 1 1 1 1 1 1 1 1 1 1 615.49830147 615.49830147 4.5299999555936665E-6 615.49830147 615.49830147 615.49830147 615.49830147 615.49830147 1.6153000001395412E-4 615.49830147 615.49830147 615.49830147 1000000.0 1000000.0 0.007359890262531396 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.26243776729874085 1000000.0 1000000.0 1000000.0 0.0 0.0 18.0138607189421 0.0 0.0 0.0 0.0 0.0 22.68957752827048 0.0 0.0 0.0 A A 0.0 0.0 43.095360571631836 0.0 0.0 0.0 0.0 0.0 43.97204947339241 0.0 0.0 0.0 0.99 0.99 178.88527909015906 202.30479520962623 19.0891 17.2159 0 0 8 0 0 0 0 0 9 0 0 0 -0 DG(18:3_18:2)+NH4 DG(36:5)+NH4 DG (18:3_18:2) (18:3) (18:2) 632.5248504699999 C39 H70 O5 N1 2.4516845498E8 9.767765475E7 7.7633800296287925 1.8076474533213933 1.478061445551829 1.0 111.52312375909993 0.0 0.0 2.38980069641E8 0.0 0.0 0.0 0.0 0.0 2.4516845498E8 0.0 0.0 0.0 0.0 0.0 9.5657022645E7 0.0 0.0 0.0 0.0 0.0 9.767765475E7 0.0 0.0 0.0 7.763 7.765 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.97 0.97 -1241 -1240 2109 -1239 -1238 -1237 -1236 -1235 2203 -1234 -1233 -1232 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 632.524624 632.524953 7.7633800296287925 7.7633800296287925 7.763 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.7633800296287925 7.765 7.7633800296287925 7.7633800296287925 7.7633800296287925 1.1227461E7 2.7535788E7 1 1 1 1 1 1 1 1 1 1 1 1 632.5248504699999 632.5248504699999 2.2646999991593475E-4 632.5248504699999 632.5248504699999 632.5248504699999 632.5248504699999 632.5248504699999 1.0253000004922797E-4 632.5248504699999 632.5248504699999 632.5248504699999 1000000.0 1000000.0 0.358041268651588 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1620963982253704 1000000.0 1000000.0 1000000.0 0.0 0.0 15.527663592181801 0.0 0.0 0.0 0.0 0.0 22.183029783095748 0.0 0.0 0.0 B B 0.0 0.0 51.17202341041677 0.0 0.0 0.0 0.0 0.0 54.61068867619149 0.0 0.0 0.0 1.0 1.0 169.1608878934142 111.52312375909993 47.8245 62.1332 0 0 8 0 0 0 0 0 9 0 0 0 -0 DG(18:3_18:3)+NH4 DG(36:6)+NH4 DG (18:3_18:3) (18:3) (18:3) 630.5092004700001 C39 H68 O5 N1 6.34088331703E8 2.9650797215E8 7.432418062476404 3.41702737563589 7.228637307296318 0.99 191.31962964009267 0.0 0.0 6.04169505851E8 0.0 0.0 0.0 0.0 0.0 6.34088331703E8 0.0 0.0 0.0 0.0 0.0 2.67670452036E8 0.0 0.0 0.0 0.0 0.0 2.9650797215E8 0.0 0.0 0.0 7.431 7.432 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1251 -1250 1949 -1249 -1248 -1247 -1246 -1245 2050 -1244 -1243 -1242 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 630.509119 630.509421 7.432418062476404 7.432418062476404 7.431 7.432418062476404 7.432418062476404 7.432418062476404 7.432418062476404 7.432418062476404 7.432 7.432418062476404 7.432418062476404 7.432418062476404 2.0664012E7 1.8020704E7 1 1 1 1 1 1 1 1 1 1 1 1 630.5092004700001 630.5092004700001 8.147000005465088E-5 630.5092004700001 630.5092004700001 630.5092004700001 630.5092004700001 630.5092004700001 2.2052999986499344E-4 630.5092004700001 630.5092004700001 630.5092004700001 1000000.0 1000000.0 0.1292130233689227 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3497649196880932 1000000.0 1000000.0 1000000.0 0.0 0.0 19.8377437176894 0.0 0.0 0.0 0.0 0.0 17.47977052687941 0.0 0.0 0.0 A A 0.0 0.0 48.78749975546347 0.0 0.0 0.0 0.0 0.0 42.988472501802036 0.0 0.0 0.0 0.99 0.99 231.05131831489692 191.31962964009267 81.1495 96.603 0 0 8 0 0 0 0 0 8 0 0 0 -0 DG(18:3_18:3)+H DG(36:6)+H DG (18:3_18:3) (18:3) (18:3) 613.4826514700002 C39 H65 O5 1.5308509449E8 6.1627567478E7 7.432418062476404 1.1296314281859703 3.3244661049889532 1.0 306.16205827151475 0.0 0.0 1.50658878625E8 0.0 0.0 0.0 0.0 0.0 1.5308509449E8 0.0 0.0 0.0 0.0 0.0 5.8796691175E7 0.0 0.0 0.0 0.0 0.0 6.1627567478E7 0.0 0.0 0.0 7.433 7.432 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.95 0.97 -1261 -1260 1955 -1259 -1258 -1257 -1256 -1255 2058 -1254 -1253 -1252 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 613.482863 613.483059 7.432418062476404 7.432418062476404 7.433 7.432418062476404 7.432418062476404 7.432418062476404 7.432418062476404 7.432418062476404 7.432 7.432418062476404 7.432418062476404 7.432418062476404 1.9412172E7 4.1105712E7 1 1 1 1 1 1 1 1 1 1 1 1 613.4826514700002 613.4826514700002 2.1152999977402942E-4 613.4826514700002 613.4826514700002 613.4826514700002 613.4826514700002 613.4826514700002 4.075299998476112E-4 613.4826514700002 613.4826514700002 613.4826514700002 1000000.0 1000000.0 0.34480192596672543 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.664289363148421 1000000.0 1000000.0 1000000.0 0.0 0.0 16.518576761972017 0.0 0.0 0.0 0.0 0.0 17.15335456662734 0.0 0.0 0.0 A A 0.0 0.0 39.70811721627889 0.0 0.0 0.0 0.0 0.0 41.23402540054649 0.0 0.0 0.0 0.99 1.0 332.95787067205583 306.16205827151475 16.0676 18.2501 0 0 8 0 0 0 0 0 9 0 0 0 -0 DG(18:0_20:4)+NH4 DG(38:4)+NH4 DG (18:0_20:4) (18:0) (20:4) 662.5718004700001 C41 H76 O5 N1 1.0161378456E7 4258456.589 8.579909992143197 7.160903032325367 11.082305850615848 1.0 4838514.0 0.0 0.0 9181925.779 0.0 0.0 0.0 0.0 0.0 1.0161378456E7 0.0 0.0 0.0 0.0 0.0 3639540.063 0.0 0.0 0.0 0.0 0.0 4258456.589 0.0 0.0 0.0 8.576 8.583 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.93 0.91 -1271 -1270 2489 -1269 -1268 -1267 -1266 -1265 2574 -1264 -1263 -1262 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 662.570074 662.572182 8.579909992143197 8.579909992143197 8.576 8.579909992143197 8.579909992143197 8.579909992143197 8.579909992143197 8.579909992143197 8.583 8.579909992143197 8.579909992143197 8.579909992143197 4077990.75 4838514.0 1 1 1 1 1 1 1 1 1 1 1 1 662.5718004700001 662.5718004700001 0.0017264700001078381 662.5718004700001 662.5718004700001 662.5718004700001 662.5718004700001 662.5718004700001 3.8152999991325487E-4 662.5718004700001 662.5718004700001 662.5718004700001 1000000.0 1000000.0 2.605710051172045 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5758319319394726 1000000.0 1000000.0 1000000.0 0.0 0.0 8.797593764870893 0.0 0.0 0.0 0.0 0.0 10.378139384862308 0.0 0.0 0.0 B B 0.0 0.0 29.179263723527892 0.0 0.0 0.0 0.0 0.0 34.42151049070097 0.0 0.0 0.0 0.99 1.0 4152036.25 4838514.0 16.4159 9.8306 0 0 8 0 0 0 0 0 8 0 0 0 -0 DG(20:3_18:2)+NH4 DG(38:5)+NH4 DG (20:3_18:2) (20:3) (18:2) 660.55615047 C41 H74 O5 N1 1.5579832349E7 6173685.197 8.113 0.04265642599197752 3.375920842555814 1.0 28.342198060534823 0.0 0.0 1.5579832349E7 0.0 0.0 0.0 0.0 0.0 1.5570436603E7 0.0 0.0 0.0 0.0 0.0 5885808.616 0.0 0.0 0.0 0.0 0.0 6173685.197 0.0 0.0 0.0 8.116 8.122 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.94 0.96 -1282 -1281 2286 -1280 -1279 -1278 -1277 -1276 -1275 -1274 -1273 -1272 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 660.556092 660.55615 8.113 8.113 8.116 8.113 8.113 8.113 8.113 8.113 8.122 8.113 8.113 8.113 6348483.0 1 1 1 1 1 1 1 1 1 1 1 1 660.55615047 660.55615047 5.846999999903346E-5 660.55615047 660.55615047 660.55615047 660.55615047 660.55615047 4.70000031782547E-7 660.55615047 660.55615047 660.55615047 1000000.0 1000000.0 0.08851632061472865 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.11521694935596E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 16.590686135765125 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 41.638333514790794 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 28.342198060534823 20.055724740967584 9.2583 19.2443 0 0 9 0 0 0 0 0 9 0 0 0 -0 DG(18:3_20:3)+NH4 DG(38:6)+NH4 DG (18:3_20:3) (18:3) (20:3) 658.54050047 C41 H72 O5 N1 2.1437316658E7 8607754.234 7.8289784709776296 3.830442223285419 0.9523333493743215 0.99 1.0085098E7 0.0 0.0 2.0306667623E7 0.0 0.0 0.0 0.0 0.0 2.1437316658E7 0.0 0.0 0.0 0.0 0.0 8607754.234 0.0 0.0 0.0 0.0 0.0 8492600.213 0.0 0.0 0.0 7.827 7.829 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.95 0.95 -1292 -1291 2152 -1290 -1289 -1288 -1287 -1286 2253 -1285 -1284 -1283 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 658.540409 658.540178 7.8289784709776296 7.8289784709776296 7.827 7.8289784709776296 7.8289784709776296 7.8289784709776296 7.8289784709776296 7.8289784709776296 7.829 7.8289784709776296 7.8289784709776296 7.8289784709776296 8952673.0 7312076.0 1 1 1 1 1 1 1 1 1 1 1 1 658.54050047 658.54050047 9.147000002940331E-5 658.54050047 658.54050047 658.54050047 658.54050047 658.54050047 3.2247000001461856E-4 658.54050047 658.54050047 658.54050047 1000000.0 1000000.0 0.13889806316258638 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4896737555009478 1000000.0 1000000.0 1000000.0 0.0 0.0 25.562122090655393 0.0 0.0 0.0 0.0 0.0 13.789348056739398 0.0 0.0 0.0 A B 0.0 0.0 50.955530488958075 0.0 0.0 0.0 0.0 0.0 45.73557659933853 0.0 0.0 0.0 1.0 0.99 1.0496022E7 1.0085098E7 7.4841 8.0136 0 0 9 0 0 0 0 0 8 0 0 0 -0 Hex3Cer(d34:1)+H-H2O Hex3Cer(d34:1)+H-H2O Hex3Cer (d34:1) (d34:1) 1006.66728047 C52 H96 O17 N1 887725.733 381071.131 7.431242156630803 10.546261201167034 10.611316661601808 0.98 52.497309812877866 742928.126 884940.791 0.0 0.0 0.0 0.0 733338.798 887725.733 0.0 0.0 0.0 0.0 381071.131 304784.539 0.0 0.0 0.0 0.0 348593.437 310419.86 0.0 0.0 0.0 0.0 7.43 7.44 7.431 7.436 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -1314 -1313 -1312 -1311 -1310 -1309 -1308 285 -1307 -1306 -1305 -1304 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1006.66728 1006.66728 1006.66728 1006.666424 7.43 7.44 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 7.431 7.436 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 302595.0625 1 1 1 1 1 1 1 1 1 1 1 1 4.70000031782547E-7 4.70000031782547E-7 1006.66728047 1006.66728047 1006.66728047 1006.66728047 4.70000031782547E-7 8.564700000306402E-4 1006.66728047 1006.66728047 1006.66728047 1006.66728047 4.6688716411157224E-4 4.6688716411157224E-4 1000000.0 1000000.0 1000000.0 1000000.0 4.6688716411157224E-4 0.8507974945115583 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.861410120069698 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 37.153525300174245 0.0 0.0 0.0 0.0 0.98 0.99 0.98 0.98 386960.66 90.25275151750358 350479.63 52.497309812877866 6.2239 35.5134 5.369 19.9982 8 11 0 0 0 0 9 12 0 0 0 0 -0 Hex3Cer(d34:1)+H Hex3Cer(d34:1)+H Hex3Cer (d34:1) (d34:1) 1024.67784547 C52 H98 O18 N1 1935751.187 743216.808 7.431242156630803 0.9780612012646976 10.195232878769009 0.99 732698.06 1935751.187 0.0 0.0 0.0 0.0 0.0 1909160.023 0.0 0.0 0.0 0.0 0.0 643263.782 0.0 0.0 0.0 0.0 0.0 743216.808 0.0 0.0 0.0 0.0 0.0 7.431 7.43 0.023 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.95 0.93 -1325 -1324 -1323 -1322 -1321 -1320 363 -1319 -1318 -1317 -1316 -1315 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1024.67785 1024.679414 7.431 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 7.43 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 7.431242156630803 576235.75 1 1 1 1 1 1 1 1 1 1 1 1 4.530000069280504E-6 1024.67784547 1024.67784547 1024.67784547 1024.67784547 1024.67784547 0.0015685299999859126 1024.67784547 1024.67784547 1024.67784547 1024.67784547 1024.67784547 0.004420901739319523 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5307542823534532 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 9.110148141378465 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 45.55074070689232 0.0 0.0 0.0 0.0 0.0 0.99 0.99 732698.06 933107.81 7.0752 7.7512 10 0 0 0 0 0 8 0 0 0 0 0 -0 Hex3Cer(d34:1+O)+H Hex3Cer(d34:1+O)+H Hex3Cer (d34:1+O) (d34:1+O) 1040.6727604699997 C52 H98 O19 N1 3456068.948 1495509.525 7.338 3.8490070513545334 13.688361766739105 1.0 102.4668505568647 3272928.582 0.0 0.0 0.0 0.0 0.0 3456068.948 0.0 0.0 0.0 0.0 0.0 1495509.525 0.0 0.0 0.0 0.0 0.0 1231553.46 0.0 0.0 0.0 0.0 0.0 7.333 7.333 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 1.0 0.95 -1336 -1335 -1334 -1333 -1332 -1331 334 -1330 -1329 -1328 -1327 -1326 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1040.67276 1040.673402 7.333 7.338 7.338 7.338 7.338 7.338 7.333 7.338 7.338 7.338 7.338 7.338 690392.4375 1 1 1 1 1 1 1 1 1 1 1 1 4.6999980440887157E-7 1040.6727604699997 1040.6727604699997 1040.6727604699997 1040.6727604699997 1040.6727604699997 6.415300001663127E-4 1040.6727604699997 1040.6727604699997 1040.6727604699997 1040.6727604699997 1040.6727604699997 4.5163073567583846E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.616456992567556 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 15.968877628393201 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 53.229592094644005 0.0 0.0 0.0 0.0 0.0 0.99 1.0 485.59733420003874 102.4668505568647 11.9335 15.3106 9 0 0 0 0 0 9 0 0 0 0 0 -0 Hex3Cer(d16:1_23:0+O)+H Hex3Cer(d39:1+O)+H Hex3Cer (d16:1_23:0+O) (d16:1) (23:0+O) 1110.7510104699998 C57 H108 O19 N1 978380.957 401463.864 8.356 15.047860978943136 13.629284149543214 1.0 14.94353495394305 978380.957 0.0 0.0 0.0 0.0 0.0 790196.458 0.0 0.0 0.0 0.0 0.0 401463.864 0.0 0.0 0.0 0.0 0.0 330884.793 0.0 0.0 0.0 0.0 0.0 8.354 8.359 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 675 -1347 -1346 -1345 -1344 -1343 -1342 -1341 -1340 -1339 -1338 -1337 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1110.752531 1110.75101 8.354 8.356 8.356 8.356 8.356 8.356 8.359 8.356 8.356 8.356 8.356 8.356 216662.5625 1 1 1 1 1 1 1 1 1 1 1 1 0.0015205300003344746 1110.7510104699998 1110.7510104699998 1110.7510104699998 1110.7510104699998 1110.7510104699998 4.6999980440887157E-7 1110.7510104699998 1110.7510104699998 1110.7510104699998 1110.7510104699998 1110.7510104699998 1.3689206545858394 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.231369586690696E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 12.574991163449015 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 31.437477908622537 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 14.94353495394305 12.315319799917313 12.4687 13.1326 9 0 0 0 0 0 7 0 0 0 0 0 -0 Hex3Cer(d16:1_24:0+O)+H Hex3Cer(d40:1+O)+H Hex3Cer (d16:1_24:0+O) (d16:1) (24:0+O) 1124.7666604699998 C58 H110 O19 N1 1689486.152 624337.372 8.523928138989824 3.5253740681443357 3.520932996467819 0.99 857.0517093292648 1607303.261 0.0 0.0 0.0 0.0 0.0 1689486.152 0.0 0.0 0.0 0.0 0.0 594004.609 0.0 0.0 0.0 0.0 0.0 624337.372 0.0 0.0 0.0 0.0 0.0 8.521 8.526 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.91 0.92 714 -1357 -1356 -1355 -1354 -1353 705 -1352 -1351 -1350 -1349 -1348 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1124.771397 1124.769414 8.521 8.523928138989824 8.523928138989824 8.523928138989824 8.523928138989824 8.523928138989824 8.526 8.523928138989824 8.523928138989824 8.523928138989824 8.523928138989824 8.523928138989824 420750.8125 758804.125 1 1 1 1 1 1 1 1 1 1 1 1 0.004736530000172934 1124.7666604699998 1124.7666604699998 1124.7666604699998 1124.7666604699998 1124.7666604699998 0.0027535300002909935 1124.7666604699998 1124.7666604699998 1124.7666604699998 1124.7666604699998 1124.7666604699998 4.211122330202877 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.4480899879628293 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 10.983670023948513 0.0 0.0 0.0 0.0 0.0 22.52183831486277 0.0 0.0 0.0 0.0 0.0 A A 27.45917505987128 0.0 0.0 0.0 0.0 0.0 45.04367662972554 0.0 0.0 0.0 0.0 0.0 0.99 0.99 49.82365134574694 857.0517093292648 24.2122 26.4502 11 0 0 0 0 0 10 0 0 0 0 0 -0 Hex3Cer(d18:1_24:0+O)+H Hex3Cer(d42:1+O)+H Hex3Cer (d18:1_24:0+O) (d18:1) (24:0+O) 1152.79796047 C60 H114 O19 N1 821122.771 351707.107 8.80448439620533 4.699031139048023 2.7562223699423556 0.99 34.752228825779326 821122.771 0.0 0.0 0.0 0.0 0.0 768310.408 0.0 0.0 0.0 0.0 0.0 351707.107 0.0 0.0 0.0 0.0 0.0 338260.037 0.0 0.0 0.0 0.0 0.0 8.808 8.805 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 787 -1367 -1366 -1365 -1364 -1363 780 -1362 -1361 -1360 -1359 -1358 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1152.801827 1152.802005 8.808 8.80448439620533 8.80448439620533 8.80448439620533 8.80448439620533 8.80448439620533 8.805 8.80448439620533 8.80448439620533 8.80448439620533 8.80448439620533 8.80448439620533 326715.65625 265944.625 1 1 1 1 1 1 1 1 1 1 1 1 0.003866530000095736 1152.79796047 1152.79796047 1152.79796047 1152.79796047 1152.79796047 0.0040445300001010764 1152.79796047 1152.79796047 1152.79796047 1152.79796047 1152.79796047 3.354039591221464 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.508446526442593 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 23.5258244263417 0.0 0.0 0.0 0.0 0.0 21.19811563997778 0.0 0.0 0.0 0.0 0.0 A A 47.0516488526834 0.0 0.0 0.0 0.0 0.0 42.39623127995556 0.0 0.0 0.0 0.0 0.0 0.99 0.98 34.752228825779326 52.053776139813074 18.752 16.808 11 0 0 0 0 0 11 0 0 0 0 0 -0 Hex3Cer(t16:0_24:1)+H-H2O Hex3Cer(t40:1)+H-H2O Hex3Cer (t16:0_24:1) (t16:0) (24:1) 1106.75609547 C58 H108 O18 N1 1693141.07 574191.512 8.52409672445471 2.9370038689804567 1.4892399008357384 0.98 35.442209371908504 1624246.385 0.0 0.0 0.0 0.0 0.0 1693141.07 0.0 0.0 0.0 0.0 0.0 562224.465 0.0 0.0 0.0 0.0 0.0 574191.512 0.0 0.0 0.0 0.0 0.0 8.526 8.526 0.025 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.94 0.93 716 -1377 -1376 -1375 -1374 -1373 704 -1372 -1371 -1370 -1369 -1368 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 1106.759133 1106.75916 8.526 8.52409672445471 8.52409672445471 8.52409672445471 8.52409672445471 8.52409672445471 8.526 8.52409672445471 8.52409672445471 8.52409672445471 8.52409672445471 8.52409672445471 643372.0 463197.65625 1 1 1 1 1 1 1 1 1 1 1 1 0.0030375300000287098 1106.75609547 1106.75609547 1106.75609547 1106.75609547 1106.75609547 0.003064530000074228 1106.75609547 1106.75609547 1106.75609547 1106.75609547 1106.75609547 2.7445342406167446 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.7689298596298504 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 23.532687525617572 0.0 0.0 0.0 0.0 0.0 14.048428080449758 0.0 0.0 0.0 0.0 0.0 A C 39.22114587602928 0.0 0.0 0.0 0.0 0.0 35.1210702011244 0.0 0.0 0.0 0.0 0.0 0.98 0.98 240.2991804882631 35.442209371908504 7.0812 7.3819 13 0 0 0 0 0 10 0 0 0 0 0 -0 LPC(14:0)+H LPC(14:0)+H LPC (14:0) (14:0) 468.30846847000004 C22 H47 O7 N1 P1 2.7125140728E7 3498437.712 1.474916078764939 2.053221035727103 0.10150183106547299 0.84 266.19415492985064 0.0 0.0 2.7125140728E7 0.0 0.0 0.0 0.0 0.0 2.6348781451E7 0.0 0.0 0.0 0.0 0.0 3493419.472 0.0 0.0 0.0 0.0 0.0 3498437.712 0.0 0.0 0.0 1.489 1.463 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1387 -1386 272 -1385 -1384 -1383 -1382 -1381 283 -1380 -1379 -1378 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 468.308604 468.308977 1.474916078764939 1.474916078764939 1.489 1.474916078764939 1.474916078764939 1.474916078764939 1.474916078764939 1.474916078764939 1.463 1.474916078764939 1.474916078764939 1.474916078764939 1141563.125 1008190.9375 1 1 1 1 1 1 1 1 1 1 1 1 468.30846847000004 468.30846847000004 1.3552999996591097E-4 468.30846847000004 468.30846847000004 468.30846847000004 468.30846847000004 468.30846847000004 5.085299999905146E-4 468.30846847000004 468.30846847000004 468.30846847000004 1000000.0 1000000.0 0.28940326534922156 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0858868336332277 1000000.0 1000000.0 1000000.0 0.0 0.0 26.93153832275705 0.0 0.0 0.0 0.0 0.0 27.88208363572731 0.0 0.0 0.0 B B 0.0 0.0 67.16094344827196 0.0 0.0 0.0 0.0 0.0 69.35841700429681 0.0 0.0 0.0 0.84 0.84 266.19415492985064 85.3785415016342 8.0119 11.5748 0 0 43 0 0 0 0 0 46 0 0 0 -0 LPC(14:0)+Na LPC(14:0)+Na LPC (14:0) (14:0) 490.29041347000003 C22 H46 O7 N1 P1 Na1 3913720.643 495634.335 1.474916078764939 136.78892446149868 93.52104305330758 0.94 6.127665672468755 0.0 0.0 3913720.643 0.0 0.0 0.0 0.0 0.0 65166.692700000094 0.0 0.0 0.0 0.0 0.0 495634.335 0.0 0.0 0.0 0.0 0.0 101050.47000000003 0.0 0.0 0.0 1.466 1.475 0.0 0.0 0.065 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.059 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.91 -1397 -1396 241 -1395 -1394 -1393 -1392 -1391 262 -1390 -1389 -1388 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 490.291748 490.291229 1.474916078764939 1.474916078764939 1.466 1.474916078764939 1.474916078764939 1.474916078764939 1.474916078764939 1.474916078764939 1.475 1.474916078764939 1.474916078764939 1.474916078764939 347205.15625 514915.28125 1 1 1 1 1 1 1 1 1 1 1 1 490.29041347000003 490.29041347000003 0.0013345299999514282 490.29041347000003 490.29041347000003 490.29041347000003 490.29041347000003 490.29041347000003 8.155299999543786E-4 490.29041347000003 490.29041347000003 490.29041347000003 1000000.0 1000000.0 2.721917384650405 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6633610969109422 1000000.0 1000000.0 1000000.0 0.0 0.0 12.093542563680462 0.0 0.0 0.0 0.0 0.0 11.409222686799856 0.0 0.0 0.0 B B 0.0 0.0 39.0114276247757 0.0 0.0 0.0 0.0 0.0 37.77888306887371 0.0 0.0 0.0 0.94 0.0 6.127665672468755 0.0 2.7099 1.1282 0 0 30 0 0 0 0 0 4 0 0 0 -0 LPC(15:0)+H LPC(15:0)+H LPC (15:0) (15:0) 482.32411847000003 C23 H49 O7 N1 P1 2.8906218817E7 3199536.68 1.831449201062452 1.9250869494375167 1.5649547642475559 0.94 271.2992372238887 0.0 0.0 2.8906218817E7 0.0 0.0 0.0 0.0 0.0 2.8129820277E7 0.0 0.0 0.0 0.0 0.0 3129500.183 0.0 0.0 0.0 0.0 0.0 3199536.68 0.0 0.0 0.0 1.843 1.824 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1407 -1406 333 -1405 -1404 -1403 -1402 -1401 348 -1400 -1399 -1398 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 482.324515 482.324547 1.831449201062452 1.831449201062452 1.843 1.831449201062452 1.831449201062452 1.831449201062452 1.831449201062452 1.831449201062452 1.824 1.831449201062452 1.831449201062452 1.831449201062452 1850840.875 1342162.5 1 1 1 1 1 1 1 1 1 1 1 1 482.32411847000003 482.32411847000003 3.9652999998907035E-4 482.32411847000003 482.32411847000003 482.32411847000003 482.32411847000003 482.32411847000003 4.2852999996512153E-4 482.32411847000003 482.32411847000003 482.32411847000003 1000000.0 1000000.0 0.8221235157116326 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.888468943507281 1000000.0 1000000.0 1000000.0 0.0 0.0 28.66752034021106 0.0 0.0 0.0 0.0 0.0 26.86666004279727 0.0 0.0 0.0 B B 0.0 0.0 71.49007566137423 0.0 0.0 0.0 0.0 0.0 66.99915222642713 0.0 0.0 0.0 0.94 0.92 271.2992372238887 87.2513431861088 21.0408 18.5063 0 0 64 0 0 0 0 0 58 0 0 0 -0 LPC(15:0)+Na LPC(15:0)+Na LPC (15:0) (15:0) 504.30606347 C23 H48 O7 N1 P1 Na1 2843309.397 488414.437 1.831449201062452 0.3704208044550573 1.673948034900489 0.95 487154.84 0.0 0.0 2828453.515 0.0 0.0 0.0 0.0 0.0 2843309.397 0.0 0.0 0.0 0.0 0.0 476987.362 0.0 0.0 0.0 0.0 0.0 488414.437 0.0 0.0 0.0 1.823 1.833 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1417 -1416 320 -1415 -1414 -1413 -1412 -1411 333 -1410 -1409 -1408 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 504.306062 504.306482 1.831449201062452 1.831449201062452 1.823 1.831449201062452 1.831449201062452 1.831449201062452 1.831449201062452 1.831449201062452 1.833 1.831449201062452 1.831449201062452 1.831449201062452 231820.921875 231728.390625 1 1 1 1 1 1 1 1 1 1 1 1 504.30606347 504.30606347 1.4700000292577897E-6 504.30606347 504.30606347 504.30606347 504.30606347 504.30606347 4.185299999903691E-4 504.30606347 504.30606347 504.30606347 1000000.0 1000000.0 0.0029148965989881192 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8299126865748392 1000000.0 1000000.0 1000000.0 0.0 0.0 9.53428539506472 0.0 0.0 0.0 0.0 0.0 15.722493614219424 0.0 0.0 0.0 B B 0.0 0.0 47.19943264883526 0.0 0.0 0.0 0.0 0.0 51.21333424827176 0.0 0.0 0.0 0.9 0.95 7.0467725927253815 487154.84 6.4457 4.4937 0 0 32 0 0 0 0 0 29 0 0 0 -0 LPC(16:0)+H LPC(16:0)+H LPC (16:0) (16:0) 496.3397684700001 C24 H51 O7 N1 P1 7.32357367099E8 7.5719348373E7 2.3351118580012478 8.558033543811295 0.7560395249635776 0.96 270.040685844252 0.0 0.0 7.32357367099E8 0.0 0.0 0.0 0.0 0.0 6.48778697752E8 0.0 0.0 0.0 0.0 0.0 7.5719348373E7 0.0 0.0 0.0 0.0 0.0 7.4914061149E7 0.0 0.0 0.0 2.344 2.324 0.0 0.0 0.09 0.0 0.0 0.0 0.0 0.0 0.059 0.0 0.0 0.0 0.0 0.0 0.061 0.0 0.0 0.0 0.0 0.0 0.077 0.0 0.0 0.0 0.82 0.97 -1428 -1427 -1426 -1425 -1424 -1423 -1422 -1421 430 -1420 -1419 -1418 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 496.33977 496.339966 2.3351118580012478 2.3351118580012478 2.344 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.324 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.5839382E7 1 1 1 1 1 1 1 1 1 1 1 1 496.3397684700001 496.3397684700001 1.5299999063245195E-6 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 1.9752999992306286E-4 496.3397684700001 496.3397684700001 496.3397684700001 1000000.0 1000000.0 0.0030825656204032264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3979733490466864 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 28.21885433353066 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 70.37120781429095 0.0 0.0 0.0 0.96 0.9 270.040685844252 207.49454991647164 11.9094 10.8273 0 0 35 0 0 0 0 0 36 0 0 0 -0 LPC(16:0)+K LPC(16:0)+K LPC (16:0) (16:0) 534.29565147 C24 H50 O7 N1 P1 K1 7711342.786 1055264.083 2.3351118580012478 0.8089807355327013 2.4604559119486495 0.97 44.17864804254614 0.0 0.0 7711342.786 0.0 0.0 0.0 0.0 0.0 7623621.307 0.0 0.0 0.0 0.0 0.0 1019172.923 0.0 0.0 0.0 0.0 0.0 1055264.083 0.0 0.0 0.0 2.345 2.35 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1439 -1438 371 -1437 -1436 -1435 -1434 -1433 -1432 -1431 -1430 -1429 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 534.29596 534.29565 2.3351118580012478 2.3351118580012478 2.345 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.3351118580012478 2.35 2.3351118580012478 2.3351118580012478 2.3351118580012478 341034.34375 1 1 1 1 1 1 1 1 1 1 1 1 534.29565147 534.29565147 3.085299999838753E-4 534.29565147 534.29565147 534.29565147 534.29565147 534.29565147 1.4700000292577897E-6 534.29565147 534.29565147 534.29565147 1000000.0 1000000.0 0.5774518267835815 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0027512857819699628 1000000.0 1000000.0 1000000.0 0.0 0.0 6.674071261484451 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 32.877198332435725 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.89 44.17864804254614 20.910213155008815 9.8355 8.0254 0 0 45 0 0 0 0 0 45 0 0 0 -0 LPC(16:0)+H LPC(16:0)+H LPC (16:0) (16:0) 496.3397684700001 C24 H51 O7 N1 P1 1.64061418618E8 1.5083837075E7 2.55 139.78078224728154 124.67036288724668 0.79 32.14149864249357 0.0 0.0 957158.0699999817 0.0 0.0 0.0 0.0 0.0 1.64061418618E8 0.0 0.0 0.0 0.0 0.0 949557.0 0.0 0.0 0.0 0.0 0.0 1.5083837075E7 0.0 0.0 0.0 2.524 2.549 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 1.0 -1450 -1449 -1448 -1447 -1446 -1445 -1444 -1443 489 -1442 -1441 -1440 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 496.33977 496.340177 2.55 2.55 2.524 2.55 2.55 2.55 2.55 2.55 2.549 2.55 2.55 2.55 3162347.75 1 1 1 1 1 1 1 1 1 1 1 1 496.3397684700001 496.3397684700001 1.5299999063245195E-6 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 496.3397684700001 4.0852999990192984E-4 496.3397684700001 496.3397684700001 496.3397684700001 1000000.0 1000000.0 0.0030825656204032264 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8230853658195683 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 27.760824233024962 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 69.22898811228173 0.0 0.0 0.0 0.0 0.79 0.5327093398543082 32.14149864249357 1.0542 16.9492 0 0 9 0 0 0 0 0 55 0 0 0 -0 LPC(16:1)+H LPC(16:1)+H LPC (16:1) (16:1) 494.32411847000003 C24 H49 O7 N1 P1 9.4329429907E7 9313243.274 1.6360280842420376 0.4740757274519143 2.888709822985388 0.9 124.1797971494705 0.0 0.0 9.4329429907E7 0.0 0.0 0.0 0.0 0.0 9.3699116549E7 0.0 0.0 0.0 0.0 0.0 9313243.274 0.0 0.0 0.0 0.0 0.0 8940389.764 0.0 0.0 0.0 1.641 1.632 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1470 -1469 342 -1468 -1467 -1466 -1465 -1464 337 -1463 -1462 -1461 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 494.324614 494.324493 1.6360280842420376 1.6360280842420376 1.641 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.632 1.6360280842420376 1.6360280842420376 1.6360280842420376 287391.34375 1725903.125 1 1 1 1 1 1 1 1 1 1 1 1 494.32411847000003 494.32411847000003 4.95529999966493E-4 494.32411847000003 494.32411847000003 494.32411847000003 494.32411847000003 494.32411847000003 3.745299999877716E-4 494.32411847000003 494.32411847000003 494.32411847000003 1000000.0 1000000.0 1.0024394551093834 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7576607856946016 1000000.0 1000000.0 1000000.0 0.0 0.0 26.193650123953955 0.0 0.0 0.0 0.0 0.0 25.42606955045997 0.0 0.0 0.0 B B 0.0 0.0 65.15833364167652 0.0 0.0 0.0 0.0 0.0 63.40665723306728 0.0 0.0 0.0 0.9 0.83 124.1797971494705 104.08486366453093 16.7061 17.3367 0 0 60 0 0 0 0 0 57 0 0 0 -0 LPC(16:1)+Na LPC(16:1)+Na LPC (16:1) (16:1) 516.30606347 C24 H48 O7 N1 P1 Na1 7053370.277 583926.18 1.6360280842420376 40.398430136347116 3.8048203972030348 0.83 26.637013967628377 0.0 0.0 3919001.988 0.0 0.0 0.0 0.0 0.0 7053370.277 0.0 0.0 0.0 0.0 0.0 583926.18 0.0 0.0 0.0 0.0 0.0 553329.296 0.0 0.0 0.0 1.642 1.633 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1481 -1480 -1479 -1478 -1477 -1476 -1475 -1474 325 -1473 -1472 -1471 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 516.30606 516.306477 1.6360280842420376 1.6360280842420376 1.642 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.6360280842420376 1.633 1.6360280842420376 1.6360280842420376 1.6360280842420376 369316.3125 1 1 1 1 1 1 1 1 1 1 1 1 516.30606347 516.30606347 3.470000024208275E-6 516.30606347 516.30606347 516.30606347 516.30606347 516.30606347 4.135299999461495E-4 516.30606347 516.30606347 516.30606347 1000000.0 1000000.0 0.006720819819327765 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8009396542176724 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.219806998737418 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 30.94431342655433 0.0 0.0 0.0 0.95 0.83 43.01928098383105 26.637013967628377 4.3005 5.6412 0 0 30 0 0 0 0 0 56 0 0 0 -0 LPC(17:0)+H LPC(17:0)+H LPC (17:0) (17:0) 510.35541847 C25 H53 O7 N1 P1 8315923.761 594207.851 2.977 45.94629042369719 0.6431375729554204 0.63 47.69577711093307 0.0 0.0 8315923.761 0.0 0.0 0.0 0.0 0.0 4237462.457 0.0 0.0 0.0 0.0 0.0 594207.851 0.0 0.0 0.0 0.0 0.0 588827.796 0.0 0.0 0.0 2.953 2.969 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1492 -1491 -1490 -1489 -1488 -1487 -1486 -1485 526 -1484 -1483 -1482 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 510.35542 510.355601 2.977 2.977 2.953 2.977 2.977 2.977 2.977 2.977 2.969 2.977 2.977 2.977 274032.65625 1 1 1 1 1 1 1 1 1 1 1 1 510.35541847 510.35541847 1.5299999631679384E-6 510.35541847 510.35541847 510.35541847 510.35541847 510.35541847 1.8252999996093422E-4 510.35541847 510.35541847 510.35541847 1000000.0 1000000.0 0.0029979106869380203 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3576527129037698 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.773853140476316 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 61.78018239520281 0.0 0.0 0.0 0.63 0.93 47.69577711093307 38.82584855375635 4.6269 4.7996 0 0 64 0 0 0 0 0 38 0 0 0 -0 LPC(17:0)+H LPC(17:0)+H LPC (17:0) (17:0) 510.35541847 C25 H53 O7 N1 P1 2995385.655 243492.923 3.28 2.5626207470897704 1.0433558698167875 0.08 19.84661986059112 0.0 0.0 2888762.16 0.0 0.0 0.0 0.0 0.0 2995385.655 0.0 0.0 0.0 0.0 0.0 243492.923 0.0 0.0 0.0 0.0 0.0 239926.429 0.0 0.0 0.0 3.286 3.277 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1503 -1502 -1501 -1500 -1499 -1498 -1497 -1496 633 -1495 -1494 -1493 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 510.35542 510.35624 3.28 3.28 3.286 3.28 3.28 3.28 3.28 3.28 3.277 3.28 3.28 3.28 232224.90625 1 1 1 1 1 1 1 1 1 1 1 1 510.35541847 510.35541847 1.5299999631679384E-6 510.35541847 510.35541847 510.35541847 510.35541847 510.35541847 8.215299999960735E-4 510.35541847 510.35541847 510.35541847 1000000.0 1000000.0 0.0029979106869380203 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6097213241292647 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 21.00067790594072 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 52.37076784523872 0.0 0.0 0.0 0.96 0.08 18.82437435610393 19.84661986059112 4.6269 2.2572 0 0 72 0 0 0 0 0 19 0 0 0 -0 LPC(17:1)+H LPC(17:1)+H LPC (17:1) (17:1) 508.3397684700001 C25 H51 O7 N1 P1 2.0394892684E7 1503540.085 2.053134577263613 3.7378692475822777 1.9763398123398976 0.86 10.906072576984464 0.0 0.0 2.0394892684E7 0.0 0.0 0.0 0.0 0.0 1.9344550318E7 0.0 0.0 0.0 0.0 0.0 1503540.085 0.0 0.0 0.0 0.0 0.0 1462095.819 0.0 0.0 0.0 2.063 2.04 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1513 -1512 337 -1511 -1510 -1509 -1508 -1507 354 -1506 -1505 -1504 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 508.340485 508.340515 2.053134577263613 2.053134577263613 2.063 2.053134577263613 2.053134577263613 2.053134577263613 2.053134577263613 2.053134577263613 2.04 2.053134577263613 2.053134577263613 2.053134577263613 297798.84375 304810.34375 1 1 1 1 1 1 1 1 1 1 1 1 508.3397684700001 508.3397684700001 7.165299999201125E-4 508.3397684700001 508.3397684700001 508.3397684700001 508.3397684700001 508.3397684700001 7.465299999012132E-4 508.3397684700001 508.3397684700001 508.3397684700001 1000000.0 1000000.0 1.409549369070067 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4685650153796102 1000000.0 1000000.0 1000000.0 0.0 0.0 26.75049058289127 0.0 0.0 0.0 0.0 0.0 26.13087871796943 0.0 0.0 0.0 B B 0.0 0.0 66.70945282516529 0.0 0.0 0.0 0.0 0.0 65.16428607972429 0.0 0.0 0.0 0.86 0.8 10.906072576984464 7.953464473148124 13.4445 14.5811 0 0 86 0 0 0 0 0 79 0 0 0 -0 LPC(18:0)+H LPC(18:0)+H LPC (18:0) (18:0) 524.37106847 C26 H55 O7 N1 P1 1.2102181047E7 1605237.871 3.699 15.292309448724698 15.67918201771967 0.44 74.93642524966599 0.0 0.0 9740290.056 0.0 0.0 0.0 0.0 0.0 1.2102181047E7 0.0 0.0 0.0 0.0 0.0 1284821.187 0.0 0.0 0.0 0.0 0.0 1605237.871 0.0 0.0 0.0 3.728 3.716 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1524 -1523 -1522 -1521 -1520 -1519 -1518 -1517 728 -1516 -1515 -1514 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 524.37107 524.37103 3.699 3.699 3.728 3.699 3.699 3.699 3.699 3.699 3.716 3.699 3.699 3.699 792764.0 1 1 1 1 1 1 1 1 1 1 1 1 524.37106847 524.37106847 1.5300000768547761E-6 524.37106847 524.37106847 524.37106847 524.37106847 524.37106847 3.846999993584177E-5 524.37106847 524.37106847 524.37106847 1000000.0 1000000.0 0.0029177812599748905 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.07336407793833633 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 27.039997699694464 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 67.43141570996127 0.0 0.0 0.0 0.86 0.44 38.623089298790774 74.93642524966599 5.2462 5.6055 0 0 26 0 0 0 0 0 33 0 0 0 -0 LPC(18:0)+H LPC(18:0)+H LPC (18:0) (18:0) 524.37106847 C26 H55 O7 N1 P1 2.1560864867E7 2206282.401 4.009 1.465507664542772 1.637224726355091 0.89 141.77139729167055 0.0 0.0 2.1118590303E7 0.0 0.0 0.0 0.0 0.0 2.1560864867E7 0.0 0.0 0.0 0.0 0.0 2206282.401 0.0 0.0 0.0 0.0 0.0 2155783.087 0.0 0.0 0.0 4.033 4.003 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1535 -1534 -1533 -1532 -1531 -1530 -1529 -1528 809 -1527 -1526 -1525 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 524.37107 524.371813 4.009 4.009 4.033 4.009 4.009 4.009 4.009 4.009 4.003 4.009 4.009 4.009 1330861.375 1 1 1 1 1 1 1 1 1 1 1 1 524.37106847 524.37106847 1.5300000768547761E-6 524.37106847 524.37106847 524.37106847 524.37106847 524.37106847 7.445300000199495E-4 524.37106847 524.37106847 524.37106847 1000000.0 1000000.0 0.0029177812599748905 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.41985331531033 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.528625103716525 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.50404254655854 0.0 0.0 0.0 0.95 0.89 40.639929206852976 141.77139729167055 5.8949 10.4321 0 0 56 0 0 0 0 0 57 0 0 0 -0 LPC(18:1)+H LPC(18:1)+H LPC (18:1) (18:1) 522.35541847 C26 H53 O7 N1 P1 2.15889758788E8 2.115310858E7 2.576355775158689 2.964464672513656 0.20070596989524336 0.97 231.87957416829488 0.0 0.0 2.0702465612E8 0.0 0.0 0.0 0.0 0.0 2.15889758788E8 0.0 0.0 0.0 0.0 0.0 2.1093152453E7 0.0 0.0 0.0 0.0 0.0 2.115310858E7 0.0 0.0 0.0 2.586 2.588 0.0 0.0 0.078 0.0 0.0 0.0 0.0 0.0 0.094 0.0 0.0 0.0 0.0 0.0 0.076 0.0 0.0 0.0 0.0 0.0 0.066 0.0 0.0 0.0 0.92 0.92 -1546 -1545 -1544 -1543 -1542 -1541 -1540 -1539 466 -1538 -1537 -1536 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 522.35542 522.355585 2.576355775158689 2.576355775158689 2.586 2.576355775158689 2.576355775158689 2.576355775158689 2.576355775158689 2.576355775158689 2.588 2.576355775158689 2.576355775158689 2.576355775158689 2.1082562E7 1 1 1 1 1 1 1 1 1 1 1 1 522.35541847 522.35541847 1.5299999631679384E-6 522.35541847 522.35541847 522.35541847 522.35541847 522.35541847 1.6653000000133034E-4 522.35541847 522.35541847 522.35541847 1000000.0 1000000.0 0.0029290400923749765 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.31880592047671946 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.609666845542836 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 66.35827143526895 0.0 0.0 0.0 0.94 0.97 83.74422059238297 231.87957416829488 14.706 10.1262 0 0 48 0 0 0 0 0 48 0 0 0 -0 LPC(18:1)+Na LPC(18:1)+Na LPC (18:1) (18:1) 544.33736347 C26 H52 O7 N1 P1 Na1 1.202164383E7 1184580.251 2.576355775158689 0.9978356754334975 4.160379109489761 0.73 10.409367785774721 0.0 0.0 1.1853188653E7 0.0 0.0 0.0 0.0 0.0 1.202164383E7 0.0 0.0 0.0 0.0 0.0 1116875.289 0.0 0.0 0.0 0.0 0.0 1184580.251 0.0 0.0 0.0 2.57 2.548 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1557 -1556 -1555 -1554 -1553 -1552 -1551 -1550 476 -1549 -1548 -1547 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 544.33736 544.336875 2.576355775158689 2.576355775158689 2.57 2.576355775158689 2.576355775158689 2.576355775158689 2.576355775158689 2.576355775158689 2.548 2.576355775158689 2.576355775158689 2.576355775158689 699669.5 1 1 1 1 1 1 1 1 1 1 1 1 544.33736347 544.33736347 3.470000024208275E-6 544.33736347 544.33736347 544.33736347 544.33736347 544.33736347 4.884700000502562E-4 544.33736347 544.33736347 544.33736347 1000000.0 1000000.0 0.00637472320857783 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8973662894209488 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.355724913745915 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.124878222067565 0.0 0.0 0.0 0.74 0.73 20.460407864971966 10.409367785774721 3.7418 3.9667 0 0 49 0 0 0 0 0 49 0 0 0 -0 LPC(18:1)+H LPC(18:1)+H LPC (18:1) (18:1) 522.35541847 C26 H53 O7 N1 P1 5.8726078058E7 4342060.374 2.836817300016072 3.3000780634550484 7.442470849011803 0.88 13.40096634519351 0.0 0.0 5.604782044E7 0.0 0.0 0.0 0.0 0.0 5.8726078058E7 0.0 0.0 0.0 0.0 0.0 4342060.374 0.0 0.0 0.0 0.0 0.0 3907896.368 0.0 0.0 0.0 2.84 2.829 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.115 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.12 0.0 0.0 0.0 1.0 0.86 -1568 -1567 -1566 -1565 -1564 -1563 -1562 -1561 491 -1560 -1559 -1558 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 522.35542 522.355957 2.836817300016072 2.836817300016072 2.84 2.836817300016072 2.836817300016072 2.836817300016072 2.836817300016072 2.836817300016072 2.829 2.836817300016072 2.836817300016072 2.836817300016072 3819212.25 1 1 1 1 1 1 1 1 1 1 1 1 522.35541847 522.35541847 1.5299999631679384E-6 522.35541847 522.35541847 522.35541847 522.35541847 522.35541847 5.385299999716153E-4 522.35541847 522.35541847 522.35541847 1000000.0 1000000.0 0.0029290400923749765 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0309647051216417 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.445410011581433 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 65.94865339546494 0.0 0.0 0.0 0.96 0.88 14.427017436569868 13.40096634519351 17.8302 10.0691 0 0 50 0 0 0 0 0 60 0 0 0 -0 LPC(18:1)+Na LPC(18:1)+Na LPC (18:1) (18:1) 544.33736347 C26 H52 O7 N1 P1 Na1 2670879.448 279226.656 2.836817300016072 60.02335858649278 0.12937094498702356 0.9 8.65033202982617 0.0 0.0 1079225.331 0.0 0.0 0.0 0.0 0.0 2670879.448 0.0 0.0 0.0 0.0 0.0 278716.255 0.0 0.0 0.0 0.0 0.0 279226.656 0.0 0.0 0.0 2.833 2.828 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1579 -1578 -1577 -1576 -1575 -1574 -1573 -1572 504 -1571 -1570 -1569 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 544.33736 544.337463 2.836817300016072 2.836817300016072 2.833 2.836817300016072 2.836817300016072 2.836817300016072 2.836817300016072 2.836817300016072 2.828 2.836817300016072 2.836817300016072 2.836817300016072 214912.078125 1 1 1 1 1 1 1 1 1 1 1 1 544.33736347 544.33736347 3.470000024208275E-6 544.33736347 544.33736347 544.33736347 544.33736347 544.33736347 9.95299999431154E-5 544.33736347 544.33736347 544.33736347 1000000.0 1000000.0 0.00637472320857783 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1828461660405584 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.018755057370585 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.06519820914386 0.0 0.0 0.0 0.97 0.9 8.17375040735282 8.65033202982617 5.1195 1.1836 0 0 21 0 0 0 0 0 9 0 0 0 -0 LPC(18:2)+H LPC(18:2)+H LPC (18:2) (18:2) 520.3397684700001 C26 H51 O7 N1 P1 4.34598560804E8 5.2365108607E7 1.851407826744207 138.80279132954405 118.522862179768 0.86 176.40103661524228 0.0 0.0 4061122.3199999984 0.0 0.0 0.0 0.0 0.0 4.34598560804E8 0.0 0.0 0.0 0.0 0.0 4612844.0 0.0 0.0 0.0 0.0 0.0 5.2365108607E7 0.0 0.0 0.0 1.867 1.843 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.054 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.076 0.0 0.0 0.0 0.96 0.84 -1589 -1588 312 -1587 -1586 -1585 -1584 -1583 344 -1582 -1581 -1580 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 520.340159 520.340251 1.851407826744207 1.851407826744207 1.867 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.843 1.851407826744207 1.851407826744207 1.851407826744207 2297556.25 3.4138024E7 1 1 1 1 1 1 1 1 1 1 1 1 520.3397684700001 520.3397684700001 3.9052999989053205E-4 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 520.3397684700001 4.8252999988562806E-4 520.3397684700001 520.3397684700001 520.3397684700001 1000000.0 1000000.0 0.7505288343399951 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9273363850402068 1000000.0 1000000.0 1000000.0 0.0 0.0 24.643398974553175 0.0 0.0 0.0 0.0 0.0 26.44712460790585 0.0 0.0 0.0 B B 0.0 0.0 61.45486028566878 0.0 0.0 0.0 0.0 0.0 65.95292919677271 0.0 0.0 0.0 0.0 0.86 0.0 176.40103661524228 1.063 17.6842 0 0 7 0 0 0 0 0 55 0 0 0 -0 LPC(18:2)+Na LPC(18:2)+Na LPC (18:2) (18:2) 542.3217134700001 C26 H50 O7 N1 P1 Na1 5.8043312966E7 8743139.486 1.851407826744207 3.1954402671959556 7.323840377369605 0.92 136.84097375255413 0.0 0.0 5.5478272888E7 0.0 0.0 0.0 0.0 0.0 5.8043312966E7 0.0 0.0 0.0 0.0 0.0 7882158.971 0.0 0.0 0.0 0.0 0.0 8743139.486 0.0 0.0 0.0 1.828 1.826 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1600 -1599 -1598 -1597 -1596 -1595 -1594 -1593 350 -1592 -1591 -1590 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 542.32171 542.322199 1.851407826744207 1.851407826744207 1.828 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.826 1.851407826744207 1.851407826744207 1.851407826744207 2643623.25 1 1 1 1 1 1 1 1 1 1 1 1 542.3217134700001 542.3217134700001 3.470000024208275E-6 542.3217134700001 542.3217134700001 542.3217134700001 542.3217134700001 542.3217134700001 4.855299998780538E-4 542.3217134700001 542.3217134700001 542.3217134700001 1000000.0 1000000.0 0.006398416176268825 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8952803987349699 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 16.739143422268597 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 54.88243745006098 0.0 0.0 0.0 0.79 0.92 125.05841802776344 136.84097375255413 14.8552 16.7353 0 0 47 0 0 0 0 0 41 0 0 0 -0 LPC(18:2)+K LPC(18:2)+K LPC (18:2) (18:2) 558.29565147 C26 H50 O7 N1 P1 K1 6605439.26 1216046.256 1.851407826744207 5.173901587753142 6.7941499434261585 0.95 28.889539784904002 0.0 0.0 6139177.347 0.0 0.0 0.0 0.0 0.0 6605439.26 0.0 0.0 0.0 0.0 0.0 1104559.937 0.0 0.0 0.0 0.0 0.0 1216046.256 0.0 0.0 0.0 1.828 1.824 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1610 -1609 318 -1608 -1607 -1606 -1605 -1604 331 -1603 -1602 -1601 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 558.296061 558.295235 1.851407826744207 1.851407826744207 1.828 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.851407826744207 1.824 1.851407826744207 1.851407826744207 1.851407826744207 238353.453125 270025.46875 1 1 1 1 1 1 1 1 1 1 1 1 558.29565147 558.29565147 4.095299999562485E-4 558.29565147 558.29565147 558.29565147 558.29565147 558.29565147 4.1647000000466505E-4 558.29565147 558.29565147 558.29565147 1000000.0 1000000.0 0.7335360733653404 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7459667631443911 1000000.0 1000000.0 1000000.0 0.0 0.0 10.554726949273384 0.0 0.0 0.0 0.0 0.0 10.904448584190702 0.0 0.0 0.0 B B 0.0 0.0 52.51107934961884 0.0 0.0 0.0 0.0 0.0 54.25098798104829 0.0 0.0 0.0 0.84 0.95 33.63996208709128 28.889539784904002 8.7953 11.8229 0 0 33 0 0 0 0 0 29 0 0 0 -0 LPC(18:3)+Na LPC(18:3)+Na LPC (18:3) (18:3) 540.30606347 C26 H48 O7 N1 P1 Na1 2.31559067974E8 3.5153731853E7 1.413503460446257 30.17902113341661 2.890133444026331 0.95 138.69150365922022 0.0 0.0 1.5011139154E8 0.0 0.0 0.0 0.0 0.0 2.31559067974E8 0.0 0.0 0.0 0.0 0.0 3.5153731853E7 0.0 0.0 0.0 0.0 0.0 3.374568075E7 0.0 0.0 0.0 1.428 1.424 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.056 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.051 0.0 0.0 0.0 1.0 0.86 -1620 -1619 222 -1618 -1617 -1616 -1615 -1614 271 -1613 -1612 -1611 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 540.30591 540.306148 1.413503460446257 1.413503460446257 1.428 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.424 1.413503460446257 1.413503460446257 1.413503460446257 2509297.0 1.463862E7 1 1 1 1 1 1 1 1 1 1 1 1 540.30606347 540.30606347 1.534699999865552E-4 540.30606347 540.30606347 540.30606347 540.30606347 540.30606347 8.452999998098676E-5 540.30606347 540.30606347 540.30606347 1000000.0 1000000.0 0.2840427127560386 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1564483645401107 1000000.0 1000000.0 1000000.0 0.0 0.0 32.23544053645029 0.0 0.0 0.0 0.0 0.0 32.077602139838525 0.0 0.0 0.0 B B 0.0 0.0 62.95984479775449 0.0 0.0 0.0 0.0 0.0 63.14488610204435 0.0 0.0 0.0 0.3 0.95 121.22042222571876 138.69150365922022 4.8134 27.746 0 0 11 0 0 0 0 0 31 0 0 0 -0 LPC(18:3)+H LPC(18:3)+H LPC (18:3) (18:3) 518.32411847 C26 H49 O7 N1 P1 1.845177910802E9 2.29413056973E8 1.413503460446257 141.0156272309566 137.8607149291592 0.95 288.4681721894878 0.0 0.0 1.845177910802E9 0.0 0.0 0.0 0.0 0.0 2650652.159999963 0.0 0.0 0.0 0.0 0.0 2.29413056973E8 0.0 0.0 0.0 0.0 0.0 2924848.0 0.0 0.0 0.0 1.42 1.416 0.0 0.0 0.076 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.05 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.81 0.88 -1630 -1629 290 -1628 -1627 -1626 -1625 -1624 227 -1623 -1622 -1621 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 518.324676 518.324407 1.413503460446257 1.413503460446257 1.42 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.416 1.413503460446257 1.413503460446257 1.413503460446257 8167119.0 388046.15625 1 1 1 1 1 1 1 1 1 1 1 1 518.32411847 518.32411847 5.575299999236449E-4 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 2.885299999206836E-4 518.32411847 518.32411847 518.32411847 1000000.0 1000000.0 1.0756397012150885 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5566594137513271 1000000.0 1000000.0 1000000.0 0.0 0.0 27.739716493895834 0.0 0.0 0.0 0.0 0.0 26.5436648414703 0.0 0.0 0.0 B B 0.0 0.0 69.00426988531304 0.0 0.0 0.0 0.0 0.0 66.02901701858285 0.0 0.0 0.0 0.95 0.0 288.4681721894878 0.0 29.3715 1.0133 0 0 34 0 0 0 0 0 3 0 0 0 -0 LPC(18:3)+K LPC(18:3)+K LPC (18:3) (18:3) 556.28000147 C26 H48 O7 N1 P1 K1 3.857831618E7 4486098.123 1.413503460446257 135.44649625861777 112.01553755895482 0.85 49.18430941439562 0.0 0.0 832527.2700000013 0.0 0.0 0.0 0.0 0.0 3.857831618E7 0.0 0.0 0.0 0.0 0.0 520513.75 0.0 0.0 0.0 0.0 0.0 4486098.123 0.0 0.0 0.0 1.427 1.432 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.86 1.0 -1640 -1639 243 -1638 -1637 -1636 -1635 -1634 261 -1633 -1632 -1631 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 556.279534 556.279949 1.413503460446257 1.413503460446257 1.427 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.413503460446257 1.432 1.413503460446257 1.413503460446257 1.413503460446257 4166319.25 4490134.5 1 1 1 1 1 1 1 1 1 1 1 1 556.28000147 556.28000147 4.6746999998958927E-4 556.28000147 556.28000147 556.28000147 556.28000147 556.28000147 5.2470000014182006E-5 556.28000147 556.28000147 556.28000147 1000000.0 1000000.0 0.8403501811215117 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.09432300258058386 1000000.0 1000000.0 1000000.0 0.0 0.0 10.598335925314782 0.0 0.0 0.0 0.0 0.0 10.294026748278837 0.0 0.0 0.0 B B 0.0 0.0 52.72803942942679 0.0 0.0 0.0 0.0 0.0 51.21406342427284 0.0 0.0 0.0 0.0 0.85 50.77564216089938 49.18430941439562 1.0918 18.8408 0 0 4 0 0 0 0 0 37 0 0 0 -0 LPC(18:3)+H LPC(18:3)+H LPC (18:3) (18:3) 518.32411847 C26 H49 O7 N1 P1 8.2527472529E7 9635120.786 2.321 16.39404774247759 1.31810676564687 0.94 12.254545041694172 0.0 0.0 8.2527472529E7 0.0 0.0 0.0 0.0 0.0 6.5381372838E7 0.0 0.0 0.0 0.0 0.0 9635120.786 0.0 0.0 0.0 0.0 0.0 9457172.549 0.0 0.0 0.0 2.343 2.326 0.0 0.0 0.068 0.0 0.0 0.0 0.0 0.0 0.055 0.0 0.0 0.0 0.0 0.0 0.066 0.0 0.0 0.0 0.0 0.0 0.053 0.0 0.0 0.0 0.81 0.91 -1662 -1661 -1660 -1659 -1658 -1657 -1656 -1655 416 -1654 -1653 -1652 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 518.32412 518.322 2.321 2.321 2.343 2.321 2.321 2.321 2.321 2.321 2.326 2.321 2.321 2.321 8006752.0 1 1 1 1 1 1 1 1 1 1 1 1 518.32411847 518.32411847 1.5299999631679384E-6 518.32411847 518.32411847 518.32411847 518.32411847 518.32411847 0.002118470000027628 518.32411847 518.32411847 518.32411847 1000000.0 1000000.0 0.002951820894779553 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.087153046786578 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 15.66461352301572 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 38.58279192861016 0.0 0.0 0.0 0.94 0.9 12.254545041694172 15.894660813816719 5.3137 5.2488 0 0 46 0 0 0 0 0 48 0 0 0 -0 LPC(20:1)+H LPC(20:1)+H LPC (20:1) (20:1) 550.38671847 C28 H57 O7 N1 P1 8750301.466 773474.89 3.982991332957159 2.6845737011339716 0.7954920928961291 0.96 21.103027818867012 0.0 0.0 8750301.466 0.0 0.0 0.0 0.0 0.0 8424279.779 0.0 0.0 0.0 0.0 0.0 764822.003 0.0 0.0 0.0 0.0 0.0 773474.89 0.0 0.0 0.0 3.981 3.951 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1672 -1671 744 -1670 -1669 -1668 -1667 -1666 804 -1665 -1664 -1663 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 550.387383 550.38739 3.982991332957159 3.982991332957159 3.981 3.982991332957159 3.982991332957159 3.982991332957159 3.982991332957159 3.982991332957159 3.951 3.982991332957159 3.982991332957159 3.982991332957159 435604.53125 461819.375 1 1 1 1 1 1 1 1 1 1 1 1 550.38671847 550.38671847 6.645299999945564E-4 550.38671847 550.38671847 550.38671847 550.38671847 550.38671847 6.715299999768831E-4 550.38671847 550.38671847 550.38671847 1000000.0 1000000.0 1.2073874199614758 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2201057500872203 1000000.0 1000000.0 1000000.0 0.0 0.0 19.029874999878647 0.0 0.0 0.0 0.0 0.0 27.088792755974985 0.0 0.0 0.0 B B 0.0 0.0 63.408948055156976 0.0 0.0 0.0 0.0 0.0 67.55309914208229 0.0 0.0 0.0 0.96 0.96 21.103027818867012 61.16169818340329 5.0099 4.9955 0 0 68 0 0 0 0 0 53 0 0 0 -0 LPC(20:1e)+H LPC(20:1e)+H LPC (20:1e) (20:1e) 536.4074534700001 C28 H59 O6 N1 P1 3311570.691 350189.465 4.547605458219681 4.095990085035684 4.287463930539412 0.89 20.35806914485943 0.0 0.0 3125143.972 0.0 0.0 0.0 0.0 0.0 3311570.691 0.0 0.0 0.0 0.0 0.0 329580.902 0.0 0.0 0.0 0.0 0.0 350189.465 0.0 0.0 0.0 4.545 4.55 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1682 -1681 845 -1680 -1679 -1678 -1677 -1676 911 -1675 -1674 -1673 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 536.408095 536.408348 4.547605458219681 4.547605458219681 4.545 4.547605458219681 4.547605458219681 4.547605458219681 4.547605458219681 4.547605458219681 4.55 4.547605458219681 4.547605458219681 4.547605458219681 271752.6875 229892.296875 1 1 1 1 1 1 1 1 1 1 1 1 536.4074534700001 536.4074534700001 6.41529999938939E-4 536.4074534700001 536.4074534700001 536.4074534700001 536.4074534700001 536.4074534700001 8.945299999822964E-4 536.4074534700001 536.4074534700001 536.4074534700001 1000000.0 1000000.0 1.1959751785492634 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6676315629016987 1000000.0 1000000.0 1000000.0 0.0 0.0 5.1681779834063795 0.0 0.0 0.0 0.0 0.0 13.9587079412663 0.0 0.0 0.0 B B 0.0 0.0 53.61221534065288 0.0 0.0 0.0 0.0 0.0 46.51144512354949 0.0 0.0 0.0 0.8 0.89 91.68876637478108 20.35806914485943 3.3784 3.8006 0 0 38 0 0 0 0 0 38 0 0 0 -0 LPC(20:2)+H LPC(20:2)+H LPC (20:2) (20:2) 548.37106847 C28 H55 O7 N1 P1 1.4034093349E7 1327947.67 2.90911966141861 1.1719746911944666 2.7689659001752776 0.92 104.56990960373935 0.0 0.0 1.4034093349E7 0.0 0.0 0.0 0.0 0.0 1.3803400902E7 0.0 0.0 0.0 0.0 0.0 1276945.054 0.0 0.0 0.0 0.0 0.0 1327947.67 0.0 0.0 0.0 2.906 2.912 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1692 -1691 468 -1690 -1689 -1688 -1687 -1686 509 -1685 -1684 -1683 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 548.370923 548.370858 2.90911966141861 2.90911966141861 2.906 2.90911966141861 2.90911966141861 2.90911966141861 2.90911966141861 2.90911966141861 2.912 2.90911966141861 2.90911966141861 2.90911966141861 646715.9375 384122.09375 1 1 1 1 1 1 1 1 1 1 1 1 548.37106847 548.37106847 1.4547000000675325E-4 548.37106847 548.37106847 548.37106847 548.37106847 548.37106847 2.1046999995633087E-4 548.37106847 548.37106847 548.37106847 1000000.0 1000000.0 0.26527657706783553 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.38380945322946985 1000000.0 1000000.0 1000000.0 0.0 0.0 25.248021490590542 0.0 0.0 0.0 0.0 0.0 16.337842905948712 0.0 0.0 0.0 B B 0.0 0.0 62.340793803927276 0.0 0.0 0.0 0.0 0.0 54.079565762012635 0.0 0.0 0.0 0.92 0.93 104.56990960373935 120.27778407657055 8.1903 9.2374 0 0 51 0 0 0 0 0 46 0 0 0 -0 LPC(20:3)+H LPC(20:3)+H LPC (20:3) (20:3) 546.35541847 C28 H53 O7 N1 P1 5.887685225E7 5586060.914 2.127481965739842 1.7080599348711982 1.3402008022954934 0.91 205.5790013724244 0.0 0.0 5.887685225E7 0.0 0.0 0.0 0.0 0.0 5.7471617811E7 0.0 0.0 0.0 0.0 0.0 5481180.532 0.0 0.0 0.0 0.0 0.0 5586060.914 0.0 0.0 0.0 2.129 2.124 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1702 -1701 359 -1700 -1699 -1698 -1697 -1696 380 -1695 -1694 -1693 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 546.356018 546.356032 2.127481965739842 2.127481965739842 2.129 2.127481965739842 2.127481965739842 2.127481965739842 2.127481965739842 2.127481965739842 2.124 2.127481965739842 2.127481965739842 2.127481965739842 4184585.0 3980082.0 1 1 1 1 1 1 1 1 1 1 1 1 546.35541847 546.35541847 5.99529999931292E-4 546.35541847 546.35541847 546.35541847 546.35541847 546.35541847 6.135300000096322E-4 546.35541847 546.35541847 546.35541847 1000000.0 1000000.0 1.0973259890241422 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1229503346516563 1000000.0 1000000.0 1000000.0 0.0 0.0 27.685769613935506 0.0 0.0 0.0 0.0 0.0 27.008379151126064 0.0 0.0 0.0 B B 0.0 0.0 69.04181948612347 0.0 0.0 0.0 0.0 0.0 67.35256646166103 0.0 0.0 0.0 0.91 0.91 205.5790013724244 93.46313098275387 18.2132 11.5868 0 0 65 0 0 0 0 0 62 0 0 0 -0 LPC(20:3)+Na LPC(20:3)+Na LPC (20:3) (20:3) 568.33736347 C28 H52 O7 N1 P1 Na1 3008510.008 398439.603 2.127481965739842 0.5423548050122771 4.385418681164346 0.93 6.753080332446314 0.0 0.0 3008510.008 0.0 0.0 0.0 0.0 0.0 2985522.727 0.0 0.0 0.0 0.0 0.0 374471.931 0.0 0.0 0.0 0.0 0.0 398439.603 0.0 0.0 0.0 2.131 2.123 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1712 -1711 353 -1710 -1709 -1708 -1707 -1706 374 -1705 -1704 -1703 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 568.337718 568.337606 2.127481965739842 2.127481965739842 2.131 2.127481965739842 2.127481965739842 2.127481965739842 2.127481965739842 2.127481965739842 2.123 2.127481965739842 2.127481965739842 2.127481965739842 260549.390625 253090.15625 1 1 1 1 1 1 1 1 1 1 1 1 568.33736347 568.33736347 3.545299999814233E-4 568.33736347 568.33736347 568.33736347 568.33736347 568.33736347 2.4253000003682246E-4 568.33736347 568.33736347 568.33736347 1000000.0 1000000.0 0.6238020281067397 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4267359769487063 1000000.0 1000000.0 1000000.0 0.0 0.0 18.51575749205275 0.0 0.0 0.0 0.0 0.0 11.6210954593933 0.0 0.0 0.0 B B 0.0 0.0 60.50901141193712 0.0 0.0 0.0 0.0 0.0 55.87065124708319 0.0 0.0 0.0 0.93 0.93 6.753080332446314 5.428201304824817 4.2845 3.3271 0 0 39 0 0 0 0 0 34 0 0 0 -0 LPC(20:4)+H LPC(20:4)+H LPC (20:4) (20:4) 544.3397684700001 C28 H51 O7 N1 P1 2696865.815 448199.93 1.765 2.1231638958030405 0.3492913623874891 0.98 23.941511795970246 0.0 0.0 2696865.815 0.0 0.0 0.0 0.0 0.0 2617087.247 0.0 0.0 0.0 0.0 0.0 445991.4 0.0 0.0 0.0 0.0 0.0 448199.93 0.0 0.0 0.0 1.763 1.769 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1723 -1722 301 -1721 -1720 -1719 -1718 -1717 -1716 -1715 -1714 -1713 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 544.339881 544.33977 1.765 1.765 1.763 1.765 1.765 1.765 1.765 1.765 1.769 1.765 1.765 1.765 336225.90625 1 1 1 1 1 1 1 1 1 1 1 1 544.3397684700001 544.3397684700001 1.1252999991029355E-4 544.3397684700001 544.3397684700001 544.3397684700001 544.3397684700001 544.3397684700001 1.5299999631679384E-6 544.3397684700001 544.3397684700001 544.3397684700001 1000000.0 1000000.0 0.2067275007787629 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00281074441330711 1000000.0 1000000.0 1000000.0 0.0 0.0 16.06096683394112 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 53.51632691730587 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.98 23.941511795970246 6.276501241901779 7.0032 8.4828 0 0 33 0 0 0 0 0 31 0 0 0 -0 LPC(20:5)+H LPC(20:5)+H LPC (20:5) (20:5) 542.32411847 C28 H49 O7 N1 P1 4220310.496 663626.896 1.344057528126069 36.561053456999545 2.624083997260947 0.99 3.8625290664485186 0.0 0.0 2486442.549 0.0 0.0 0.0 0.0 0.0 4220310.496 0.0 0.0 0.0 0.0 0.0 663626.896 0.0 0.0 0.0 0.0 0.0 639448.238 0.0 0.0 0.0 1.346 1.36 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.054 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.049 0.0 0.0 0.0 0.92 0.85 -1733 -1732 219 -1731 -1730 -1729 -1728 -1727 230 -1726 -1725 -1724 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 542.324316 542.324563 1.344057528126069 1.344057528126069 1.346 1.344057528126069 1.344057528126069 1.344057528126069 1.344057528126069 1.344057528126069 1.36 1.344057528126069 1.344057528126069 1.344057528126069 469803.78125 446010.0625 1 1 1 1 1 1 1 1 1 1 1 1 542.32411847 542.32411847 1.9752999992306286E-4 542.32411847 542.32411847 542.32411847 542.32411847 542.32411847 4.4452999998156884E-4 542.32411847 542.32411847 542.32411847 1000000.0 1000000.0 0.36422868391015456 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8196758817138226 1000000.0 1000000.0 1000000.0 0.0 0.0 22.51598331159387 0.0 0.0 0.0 0.0 0.0 21.090250247111467 0.0 0.0 0.0 B B 0.0 0.0 56.00990873530816 0.0 0.0 0.0 0.0 0.0 52.5941402671109 0.0 0.0 0.0 0.95 0.99 763334.31 3.8625290664485186 10.5531 8.4705 0 0 12 0 0 0 0 0 28 0 0 0 -0 LPC(20:5)+H LPC(20:5)+H LPC (20:5) (20:5) 542.32411847 C28 H49 O7 N1 P1 4.9827624994E7 7239579.111 1.824 9.288979596471009 1.0000558992796589 0.78 120.95983033460546 0.0 0.0 4.9827624994E7 0.0 0.0 0.0 0.0 0.0 4.3685408014E7 0.0 0.0 0.0 0.0 0.0 7137909.233 0.0 0.0 0.0 0.0 0.0 7239579.111 0.0 0.0 0.0 1.828 1.833 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.044 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.051 0.0 0.0 0.0 1.0 0.8 -1744 -1743 -1742 -1741 -1740 -1739 -1738 -1737 372 -1736 -1735 -1734 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 542.32412 542.321658 1.824 1.824 1.828 1.824 1.824 1.824 1.824 1.824 1.833 1.824 1.824 1.824 360330.1875 1 1 1 1 1 1 1 1 1 1 1 1 542.32411847 542.32411847 1.5299999631679384E-6 542.32411847 542.32411847 542.32411847 542.32411847 542.32411847 0.0024604700000736557 542.32411847 542.32411847 542.32411847 1000000.0 1000000.0 0.0028211910757064626 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.536899459708913 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.78265414907276 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 48.006920902943 0.0 0.0 0.0 0.78 0.91 120.95983033460546 1303.9504198995967 13.8984 14.7474 0 0 47 0 0 0 0 0 46 0 0 0 -0 LPC(22:1)+H LPC(22:1)+H LPC (22:1) (22:1) 578.41801847 C30 H61 O7 N1 P1 3110318.017 398839.695 5.204716184573522 1.9052739396433407 9.16366931714849 0.92 21.428097352895954 0.0 0.0 3110318.017 0.0 0.0 0.0 0.0 0.0 3027625.668 0.0 0.0 0.0 0.0 0.0 350297.882 0.0 0.0 0.0 0.0 0.0 398839.695 0.0 0.0 0.0 5.185 5.215 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1754 -1753 1045 -1752 -1751 -1750 -1749 -1748 1127 -1747 -1746 -1745 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 578.418344 578.418911 5.204716184573522 5.204716184573522 5.185 5.204716184573522 5.204716184573522 5.204716184573522 5.204716184573522 5.204716184573522 5.215 5.204716184573522 5.204716184573522 5.204716184573522 329397.6875 353077.4375 1 1 1 1 1 1 1 1 1 1 1 1 578.41801847 578.41801847 3.255300000546413E-4 578.41801847 578.41801847 578.41801847 578.41801847 578.41801847 8.925299999873459E-4 578.41801847 578.41801847 578.41801847 1000000.0 1000000.0 0.5627936711164627 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.543053590115014 1000000.0 1000000.0 1000000.0 0.0 0.0 16.292278651998693 0.0 0.0 0.0 0.0 0.0 15.805092274169501 0.0 0.0 0.0 B B 0.0 0.0 54.28707496771871 0.0 0.0 0.0 0.0 0.0 52.66373399857686 0.0 0.0 0.0 0.92 0.99 21.428097352895954 53.62562954052204 6.692 4.9257 0 0 36 0 0 0 0 0 29 0 0 0 -0 LPC(22:3)+H LPC(22:3)+H LPC (22:3) (22:3) 574.38671847 C30 H57 O7 N1 P1 2943260.997 260001.986 3.3471677496578836 1.8350813141179367 1.6417068145737033 0.87 13.310131743045861 0.0 0.0 2943260.997 0.0 0.0 0.0 0.0 0.0 2867856.033 0.0 0.0 0.0 0.0 0.0 254034.729 0.0 0.0 0.0 0.0 0.0 260001.986 0.0 0.0 0.0 3.353 3.357 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1764 -1763 575 -1762 -1761 -1760 -1759 -1758 638 -1757 -1756 -1755 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 574.387448 574.38761 3.3471677496578836 3.3471677496578836 3.353 3.3471677496578836 3.3471677496578836 3.3471677496578836 3.3471677496578836 3.3471677496578836 3.357 3.3471677496578836 3.3471677496578836 3.3471677496578836 235852.453125 228593.203125 1 1 1 1 1 1 1 1 1 1 1 1 574.38671847 574.38671847 7.29529999944134E-4 574.38671847 574.38671847 574.38671847 574.38671847 574.38671847 8.915299999898707E-4 574.38671847 574.38671847 574.38671847 1000000.0 1000000.0 1.2701024875494873 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5521424352649529 1000000.0 1000000.0 1000000.0 0.0 0.0 24.882943631386205 0.0 0.0 0.0 0.0 0.0 24.605625826726236 0.0 0.0 0.0 B B 0.0 0.0 61.89786972981645 0.0 0.0 0.0 0.0 0.0 61.208024444592645 0.0 0.0 0.0 0.87 0.95 13.310131743045861 29.530534236198143 4.5724 4.5635 0 0 66 0 0 0 0 0 66 0 0 0 -0 LPE(16:1)+Na LPE(16:1)+Na LPE (16:1) (16:1) 474.25911347000005 C21 H42 O7 N1 P1 Na1 4255847.588 578569.053 1.5536867571443596 1.3271046506984416 3.6503050486247677 0.68 38.45785093956887 0.0 0.0 4176716.015 0.0 0.0 0.0 0.0 0.0 4255847.588 0.0 0.0 0.0 0.0 0.0 549453.049 0.0 0.0 0.0 0.0 0.0 578569.053 0.0 0.0 0.0 1.558 1.555 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1775 -1774 -1773 -1772 -1771 -1770 -1769 -1768 279 -1767 -1766 -1765 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 474.25911 474.259491 1.5536867571443596 1.5536867571443596 1.558 1.5536867571443596 1.5536867571443596 1.5536867571443596 1.5536867571443596 1.5536867571443596 1.555 1.5536867571443596 1.5536867571443596 1.5536867571443596 412422.21875 1 1 1 1 1 1 1 1 1 1 1 1 474.25911347000005 474.25911347000005 3.470000024208275E-6 474.25911347000005 474.25911347000005 474.25911347000005 474.25911347000005 474.25911347000005 3.775299999801973E-4 474.25911347000005 474.25911347000005 474.25911347000005 1000000.0 1000000.0 0.00731667547476191 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7960416347467375 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.28842198780236 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.806849484957176 0.0 0.0 0.0 0.63 0.68 41.23324585954434 38.45785093956887 5.3176 5.302 0 0 41 0 0 0 0 0 39 0 0 0 -0 LPE(16:1)+H LPE(16:1)+H LPE (16:1) (16:1) 452.27716847000005 C21 H43 O7 N1 P1 2.7720950448E7 3653658.448 1.5536867571443596 38.105205071118434 37.25543877018519 0.74 67.22150533896414 0.0 0.0 1.3824737676E7 2.7350718792E7 0.0 0.0 0.0 0.0 1.3922118466E7 2.7720950448E7 0.0 0.0 0.0 0.0 1815737.975 3435347.091 0.0 0.0 0.0 0.0 1825171.265 3653658.448 0.0 0.0 1.548 1.573 1.549 1.557 0.0 0.0 0.0 0.064 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.06 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.72 1.0 1.0 -1784 -1783 268 -1782 -1781 -1780 -1779 -1778 302 258 -1777 -1776 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 452.2772 452.27717 452.277347 452.276907 1.5536867571443596 1.5536867571443596 1.548 1.573 1.5536867571443596 1.5536867571443596 1.5536867571443596 1.5536867571443596 1.549 1.557 1.5536867571443596 1.5536867571443596 411190.875 499979.8125 716958.125 1 1 1 1 1 1 1 1 1 1 1 1 452.27716847000005 452.27716847000005 3.152999994426864E-5 1.5299999631679384E-6 452.27716847000005 452.27716847000005 452.27716847000005 452.27716847000005 1.7852999997103325E-4 2.614700000549419E-4 452.27716847000005 452.27716847000005 1000000.0 1000000.0 0.06971388816935173 0.0033828812724368703 1000000.0 1000000.0 1000000.0 1000000.0 0.3947358222281683 0.5781189462635575 1000000.0 1000000.0 0.0 0.0 6.143896140911226 0.0 0.0 0.0 0.0 0.0 6.416136578357703 6.4519229404266465 0.0 0.0 B B B 0.0 0.0 55.350415683884925 0.0 0.0 0.0 0.0 0.0 57.28693373533663 57.09666318961635 0.0 0.0 0.55 0.93 0.9 0.74 87.30944164448117 66.09737672437576 50.71376041672649 67.22150533896414 5.9114 22.7155 8.8853 21.0507 0 0 41 47 0 0 0 0 38 45 0 0 -0 LPE(18:1)+Na LPE(18:1)+Na LPE (18:1) (18:1) 502.29041347000003 C23 H46 O7 N1 P1 Na1 1.0194875413E7 1472454.748 2.4968193265306455 2.6934357437974956 7.438253543154039 0.98 73.42302924816785 0.0 0.0 1.0194875413E7 0.0 0.0 0.0 0.0 0.0 9813800.834 0.0 0.0 0.0 0.0 0.0 1472454.748 0.0 0.0 0.0 0.0 0.0 1325302.787 0.0 0.0 0.0 2.5 2.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1795 -1794 393 -1793 -1792 -1791 -1790 -1789 -1788 -1787 -1786 -1785 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 502.289734 502.29041 2.4968193265306455 2.4968193265306455 2.5 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.5 2.4968193265306455 2.4968193265306455 2.4968193265306455 225314.0625 1 1 1 1 1 1 1 1 1 1 1 1 502.29041347000003 502.29041347000003 6.794700000227749E-4 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 3.470000024208275E-6 502.29041347000003 502.29041347000003 502.29041347000003 1000000.0 1000000.0 1.3527433170160574 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00690835407396348 1000000.0 1000000.0 1000000.0 0.0 0.0 24.056905173866216 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 59.10787512006441 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.94 73.42302924816785 85.54922200672416 5.3318 5.0393 0 0 32 0 0 0 0 0 32 0 0 0 -0 LPE(18:1)+H LPE(18:1)+H LPE (18:1) (18:1) 480.30846847000004 C23 H47 O7 N1 P1 6.3931404733E7 7241087.246 2.4968193265306455 21.357835653885644 4.1638040898672966 0.99 7394481.0 0.0 0.0 6.3931404733E7 0.0 0.0 0.0 0.0 0.0 4.7154857073E7 0.0 0.0 0.0 0.0 0.0 7241087.246 0.0 0.0 0.0 0.0 0.0 6826890.241 0.0 0.0 0.0 2.496 2.499 0.0 0.0 0.075 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.063 0.0 0.0 0.0 0.0 0.0 0.061 0.0 0.0 0.0 0.91 0.88 -1806 -1805 -1804 -1803 -1802 -1801 -1800 -1799 457 -1798 -1797 -1796 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 480.30847 480.308356 2.4968193265306455 2.4968193265306455 2.496 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.4968193265306455 2.499 2.4968193265306455 2.4968193265306455 2.4968193265306455 5386872.5 1 1 1 1 1 1 1 1 1 1 1 1 480.30846847000004 480.30846847000004 1.5299999631679384E-6 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 1.1247000003322682E-4 480.30846847000004 480.30846847000004 480.30846847000004 1000000.0 1000000.0 0.003185452815441046 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2341620175706972 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.398776322646163 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 49.07978475132875 0.0 0.0 0.0 0.99 0.97 7394481.0 6926891.5 6.9716 6.5131 0 0 33 0 0 0 0 0 31 0 0 0 -0 LPE(18:1)+Na LPE(18:1)+Na LPE (18:1) (18:1) 502.29041347000003 C23 H46 O7 N1 P1 Na1 2248601.392 291670.103 2.705 138.75178577067132 116.23074233493018 0.96 179.1172940651386 0.0 0.0 21425.32230000006 0.0 0.0 0.0 0.0 0.0 2248601.392 0.0 0.0 0.0 0.0 0.0 28516.550000000017 0.0 0.0 0.0 0.0 0.0 291670.103 0.0 0.0 0.0 2.708 2.704 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 1.0 -1817 -1816 -1815 -1814 -1813 -1812 -1811 -1810 488 -1809 -1808 -1807 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 502.29041 502.290586 2.705 2.705 2.708 2.705 2.705 2.705 2.705 2.705 2.704 2.705 2.705 2.705 276928.75 1 1 1 1 1 1 1 1 1 1 1 1 502.29041347000003 502.29041347000003 3.470000024208275E-6 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 1.725299999861818E-4 502.29041347000003 502.29041347000003 502.29041347000003 1000000.0 1000000.0 0.00690835407396348 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3434865475418562 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.29793495201671 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 59.99322935087446 0.0 0.0 0.0 0.0 0.96 0.0 179.1172940651386 1.0607 5.0393 0 0 4 0 0 0 0 0 30 0 0 0 -0 LPE(18:2)+Na LPE(18:2)+Na LPE (18:2) (18:2) 500.27476347000004 C23 H44 O7 N1 P1 Na1 1.8238098025E7 2390365.692 1.7865259782574818 1.677686355117125 2.807510145416243 0.95 190.19844240413448 0.0 0.0 1.7810452841E7 0.0 0.0 0.0 0.0 0.0 1.8238098025E7 0.0 0.0 0.0 0.0 0.0 2297305.598 0.0 0.0 0.0 0.0 0.0 2390365.692 0.0 0.0 0.0 1.783 1.803 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1828 -1827 -1826 -1825 -1824 -1823 -1822 -1821 339 -1820 -1819 -1818 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 500.27476 500.275116 1.7865259782574818 1.7865259782574818 1.783 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.803 1.7865259782574818 1.7865259782574818 1.7865259782574818 473440.59375 1 1 1 1 1 1 1 1 1 1 1 1 500.27476347000004 500.27476347000004 3.470000024208275E-6 500.27476347000004 500.27476347000004 500.27476347000004 500.27476347000004 500.27476347000004 3.5252999998647283E-4 500.27476347000004 500.27476347000004 500.27476347000004 1000000.0 1000000.0 0.006936188426015538 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7046727633056249 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.047010415019354 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 58.938751017204304 0.0 0.0 0.0 0.92 0.95 119.36736060356131 190.19844240413448 17.0707 11.1693 0 0 44 0 0 0 0 0 41 0 0 0 -0 LPE(18:2)+H LPE(18:2)+H LPE (18:2) (18:2) 478.29281847000004 C23 H45 O7 N1 P1 1.21270686683E8 1.3391215416E7 1.7865259782574818 2.529611165892889 0.9787282429207866 0.92 115.3367509781462 0.0 0.0 1.1700857315E8 0.0 0.0 0.0 0.0 0.0 1.21270686683E8 0.0 0.0 0.0 0.0 0.0 1.3391215416E7 0.0 0.0 0.0 0.0 0.0 1.3207137425E7 0.0 0.0 0.0 1.787 1.802 0.0 0.0 0.067 0.0 0.0 0.0 0.0 0.0 0.095 0.0 0.0 0.0 0.0 0.0 0.07 0.0 0.0 0.0 0.0 0.0 0.049 0.0 0.0 0.0 0.73 0.6 -1839 -1838 328 -1837 -1836 -1835 -1834 -1833 -1832 -1831 -1830 -1829 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 478.292894 478.29282 1.7865259782574818 1.7865259782574818 1.787 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.7865259782574818 1.802 1.7865259782574818 1.7865259782574818 1.7865259782574818 4236371.0 1 1 1 1 1 1 1 1 1 1 1 1 478.29281847000004 478.29281847000004 7.552999994686616E-5 478.29281847000004 478.29281847000004 478.29281847000004 478.29281847000004 478.29281847000004 1.5299999631679384E-6 478.29281847000004 478.29281847000004 478.29281847000004 1000000.0 1000000.0 0.1579158143926922 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.003198877139870551 1000000.0 1000000.0 1000000.0 0.0 0.0 5.3561068052187135 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 50.529309483195405 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.92 108.35518649620016 115.3367509781462 15.1486 15.2451 0 0 45 0 0 0 0 0 41 0 0 0 -0 MG(18:3)+H MG(18:3)+H MG (18:3) (18:3) 353.26863647000005 C21 H37 O4 1031047.5 515223.934 8.589515059698988 1.0308290245425096 0.8088288281428203 1.0 37.84357258202949 0.0 0.0 0.0 0.0 1016125.529 0.0 0.0 0.0 0.0 0.0 1031047.5 0.0 0.0 0.0 0.0 0.0 509364.025 0.0 0.0 0.0 0.0 0.0 515223.934 0.0 8.589 8.591 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1849 -1848 -1847 -1846 327 -1845 -1844 -1843 -1842 -1841 372 -1840 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 353.268545 353.268382 8.589515059698988 8.589515059698988 8.589515059698988 8.589515059698988 8.589 8.589515059698988 8.589515059698988 8.589515059698988 8.589515059698988 8.589515059698988 8.591 8.589515059698988 311229.25 495458.28125 1 1 1 1 1 1 1 1 1 1 1 1 353.26863647000005 353.26863647000005 353.26863647000005 353.26863647000005 9.147000002940331E-5 353.26863647000005 353.26863647000005 353.26863647000005 353.26863647000005 353.26863647000005 2.544700000726152E-4 353.26863647000005 1000000.0 1000000.0 1000000.0 1000000.0 0.258924768820147 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7203300089568667 1000000.0 0.0 0.0 0.0 0.0 5.868957499336874 0.0 0.0 0.0 0.0 0.0 5.623785697606632 0.0 C C 0.0 0.0 0.0 0.0 53.35415908488067 0.0 0.0 0.0 0.0 0.0 50.664736014474165 0.0 1.0 1.0 35.75499274988686 37.84357258202949 6.7949 6.0026 0 0 0 0 11 0 0 0 0 0 10 0 -0 MePC(30:4)+Na MePC(30:4)+Na MePC (30:4) (30:4) 734.4731284700001 C39 H70 O8 N1 P1 Na1 3800941.562 1559298.59 7.777 0.02690397692219414 9.08347448405014 0.98 1558224.13 0.0 0.0 3800941.562 0.0 0.0 0.0 0.0 0.0 3799495.656 0.0 0.0 0.0 0.0 0.0 1559298.59 0.0 0.0 0.0 0.0 0.0 1371080.725 0.0 0.0 0.0 7.757 7.777 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1871 -1870 -1869 -1868 -1867 -1866 -1865 -1864 2226 -1863 -1862 -1861 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 734.47313 734.469858 7.777 7.777 7.757 7.777 7.777 7.777 7.777 7.777 7.777 7.777 7.777 7.777 618480.5625 1 1 1 1 1 1 1 1 1 1 1 1 734.4731284700001 734.4731284700001 1.5299998494811007E-6 734.4731284700001 734.4731284700001 734.4731284700001 734.4731284700001 734.4731284700001 0.0032704700000749654 734.4731284700001 734.4731284700001 734.4731284700001 1000000.0 1000000.0 0.0020831256994633457 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.452810965171409 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.56279584515805 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 52.813979225790256 0.0 0.0 0.0 0.98 0.95 1558224.13 1360887.38 3.8373 2.8845 0 0 9 0 0 0 0 0 9 0 0 0 -0 MePC(31:1)+NH4 MePC(31:1)+NH4 MePC (31:1) (31:1) 749.58033247 C40 H82 O8 N2 P1 2.2728276384E7 3168127.281 8.071 3.6744078122878054 0.6409800691790852 0.69 9.946272966593428 0.0 0.0 2.1577133801E7 0.0 0.0 0.0 0.0 0.0 2.2728276384E7 0.0 0.0 0.0 0.0 0.0 3139538.332 0.0 0.0 0.0 0.0 0.0 3168127.281 0.0 0.0 0.0 8.082 8.069 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1926 -1925 -1924 -1923 -1922 -1921 -1920 -1919 2375 -1918 -1917 -1916 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 749.58033 749.5783 8.071 8.071 8.082 8.071 8.071 8.071 8.071 8.071 8.069 8.071 8.071 8.071 2526787.0 1 1 1 1 1 1 1 1 1 1 1 1 749.58033247 749.58033247 2.4700000267330324E-6 749.58033247 749.58033247 749.58033247 749.58033247 749.58033247 0.0020324700000173834 749.58033247 749.58033247 749.58033247 1000000.0 1000000.0 0.003295177207483479 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.7114772252895625 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.004416840177448 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.02208420088724 0.0 0.0 0.0 0.69 0.69 21.51310610944041 9.946272966593428 3.3849 3.0114 0 0 27 0 0 0 0 0 26 0 0 0 -0 MePC(32:5)+Na MePC(32:5)+Na MePC (32:5) (32:5) 760.48877847 C41 H72 O8 N1 P1 Na1 1.1543293502E7 3507614.44 7.818 10.083979869409301 18.043513991868693 0.81 22.10750685621735 0.0 0.0 1.0006683079E7 0.0 0.0 0.0 0.0 0.0 1.1543293502E7 0.0 0.0 0.0 0.0 0.0 2713838.48 0.0 0.0 0.0 0.0 0.0 3507614.44 0.0 0.0 0.0 7.82 7.828 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.86 1.0 -1947 -1946 2159 -1945 -1944 -1943 -1942 -1941 -1940 -1939 -1938 -1937 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 760.485543 760.48878 7.818 7.818 7.82 7.818 7.818 7.818 7.818 7.818 7.828 7.818 7.818 7.818 2003994.125 1 1 1 1 1 1 1 1 1 1 1 1 760.48877847 760.48877847 0.003235470000049645 760.48877847 760.48877847 760.48877847 760.48877847 760.48877847 1.5299999631679384E-6 760.48877847 760.48877847 760.48877847 1000000.0 1000000.0 4.254461198702985 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020118639570804587 1000000.0 1000000.0 1000000.0 0.0 0.0 11.130415892849463 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 55.65207946424731 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 0.81 12.81835967217411 22.10750685621735 2.6237 3.7559 0 0 11 0 0 0 0 0 13 0 0 0 -0 MePC(32:6)+NH4 MePC(32:6)+NH4 MePC (32:6) (32:6) 753.51773247 C41 H74 O8 N2 P1 3.9136459991E7 1.0184763015E7 7.464 8.170495942959652 8.516572178686882 0.96 14.909645813449545 0.0 0.0 3.9136459991E7 0.0 0.0 0.0 0.0 0.0 3.4861303518E7 0.0 0.0 0.0 0.0 0.0 1.0184763015E7 0.0 0.0 0.0 0.0 0.0 9027760.644 0.0 0.0 0.0 7.466 7.465 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 1.0 0.8 -1958 -1957 2009 -1956 -1955 -1954 -1953 -1952 -1951 -1950 -1949 -1948 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 753.521057 753.51773 7.464 7.464 7.466 7.464 7.464 7.464 7.464 7.464 7.465 7.464 7.464 7.464 839182.1875 1 1 1 1 1 1 1 1 1 1 1 1 753.51773247 753.51773247 0.0033245299999862254 753.51773247 753.51773247 753.51773247 753.51773247 753.51773247 2.4700000267330324E-6 753.51773247 753.51773247 753.51773247 1000000.0 1000000.0 4.412012958326214 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0032779587265139394 1000000.0 1000000.0 1000000.0 0.0 0.0 10.50322857679088 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 52.516142883954394 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.92 14.909645813449545 26.967874098918934 11.6761 12.0361 0 0 17 0 0 0 0 0 20 0 0 0 -0 MePC(32:8)+Na MePC(32:8)+Na MePC (32:8) (32:8) 754.4418284700001 C41 H66 O8 N1 P1 Na1 6184145.456 2695360.34 6.686 7.646922176350637 6.845456210495529 0.99 2428950.75 0.0 0.0 6184145.456 0.0 0.0 0.0 0.0 0.0 5549675.406 0.0 0.0 0.0 0.0 0.0 2446471.585 0.0 0.0 0.0 0.0 0.0 2695360.34 0.0 0.0 0.0 6.686 6.691 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1969 -1968 1615 -1967 -1966 -1965 -1964 -1963 -1962 -1961 -1960 -1959 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 754.438869 754.44183 6.686 6.686 6.686 6.686 6.686 6.686 6.686 6.686 6.691 6.686 6.686 6.686 2287805.75 1 1 1 1 1 1 1 1 1 1 1 1 754.4418284700001 754.4418284700001 0.002959470000178044 754.4418284700001 754.4418284700001 754.4418284700001 754.4418284700001 754.4418284700001 1.5299998494811007E-6 754.4418284700001 754.4418284700001 754.4418284700001 1000000.0 1000000.0 3.9227278876885934 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020279891593284584 1000000.0 1000000.0 1000000.0 0.0 0.0 11.260295253444438 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 56.30147626722219 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.93 2428950.75 2672306.75 7.2978 4.5476 0 0 8 0 0 0 0 0 7 0 0 0 -0 MePC(32:9)+Na MePC(32:9)+Na MePC (32:9) (32:9) 752.4261784700001 C41 H64 O8 N1 P1 Na1 8194756.732 3254252.235 6.230012922849084 2.8029549865663856 1.907083013588093 1.0 3256798.25 0.0 0.0 8194756.732 0.0 0.0 0.0 0.0 0.0 7876231.595 0.0 0.0 0.0 0.0 0.0 3254252.235 0.0 0.0 0.0 0.0 0.0 3167652.127 0.0 0.0 0.0 6.231 6.228 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -1979 -1978 1434 -1977 -1976 -1975 -1974 -1973 1532 -1972 -1971 -1970 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 752.423011 752.423134 6.230012922849084 6.230012922849084 6.231 6.230012922849084 6.230012922849084 6.230012922849084 6.230012922849084 6.230012922849084 6.228 6.230012922849084 6.230012922849084 6.230012922849084 2636571.5 3114656.5 1 1 1 1 1 1 1 1 1 1 1 1 752.4261784700001 752.4261784700001 0.0031674700001076417 752.4261784700001 752.4261784700001 752.4261784700001 752.4261784700001 752.4261784700001 0.0030444700000771263 752.4261784700001 752.4261784700001 752.4261784700001 1000000.0 1000000.0 4.209675434935616 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.04620424859196 1000000.0 1000000.0 1000000.0 0.0 0.0 10.764219769722557 0.0 0.0 0.0 0.0 0.0 11.493029577833099 0.0 0.0 0.0 C C 0.0 0.0 53.82109884861278 0.0 0.0 0.0 0.0 0.0 57.46514788916549 0.0 0.0 0.0 1.0 0.99 3256798.25 3114656.5 4.1196 3.1247 0 0 8 0 0 0 0 0 7 0 0 0 -0 MePC(33:1)+Na MePC(33:1)+Na MePC (33:1) (33:1) 782.5670284700001 C42 H82 O8 N1 P1 Na1 7.906865422907E9 1.348873558486E9 7.603 0.30025905945988907 0.7272939996138492 0.93 229.16561461747372 0.0 0.0 7.873361599652E9 0.0 0.0 0.0 0.0 0.0 7.906865422907E9 0.0 0.0 0.0 0.0 0.0 1.335070716972E9 0.0 0.0 0.0 0.0 0.0 1.348873558486E9 0.0 0.0 0.0 7.604 7.602 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.053 0.0 0.0 0.0 0.0 0.0 0.051 0.0 0.0 0.0 0.82 0.82 -2001 -2000 -1999 -1998 -1997 -1996 -1995 -1994 2291 -1993 -1992 -1991 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 782.56703 782.563843 7.603 7.603 7.604 7.603 7.603 7.603 7.603 7.603 7.602 7.603 7.603 7.603 1.1919544E7 1 1 1 1 1 1 1 1 1 1 1 1 782.5670284700001 782.5670284700001 1.5299999631679384E-6 782.5670284700001 782.5670284700001 782.5670284700001 782.5670284700001 782.5670284700001 0.003185470000062196 782.5670284700001 782.5670284700001 782.5670284700001 1000000.0 1000000.0 0.001955104045412247 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.070539499076674 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.149337971136871 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 50.74668985568436 0.0 0.0 0.0 0.92 0.93 180.9000099400737 229.16561461747372 15.7482 17.2911 0 0 30 0 0 0 0 0 30 0 0 0 -0 MePC(33:2)+Na MePC(33:2)+Na MePC (33:2) (33:2) 780.55137847 C42 H80 O8 N1 P1 Na1 6.5452513715E7 1.1121141188E7 7.682 65.22103394685365 27.36450938150935 0.89 9973686.0 0.0 0.0 6.5452513715E7 0.0 0.0 0.0 0.0 0.0 2.4135912459E7 0.0 0.0 0.0 0.0 0.0 7515097.859 0.0 0.0 0.0 0.0 0.0 1.1121141188E7 0.0 0.0 0.0 7.689 7.651 0.0 0.0 0.068 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.068 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.78 1.0 -2110 -2109 2091 -2108 -2107 -2106 -2105 -2104 -2103 -2102 -2101 -2100 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.549382 780.55138 7.682 7.682 7.689 7.682 7.682 7.682 7.682 7.682 7.651 7.682 7.682 7.682 9973686.0 1 1 1 1 1 1 1 1 1 1 1 1 780.55137847 780.55137847 0.001996469999994588 780.55137847 780.55137847 780.55137847 780.55137847 780.55137847 1.5299999631679384E-6 780.55137847 780.55137847 780.55137847 1000000.0 1000000.0 2.557768847846985 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.001960152791180732 1000000.0 1000000.0 1000000.0 0.0 0.0 11.321048868956083 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 56.60524434478042 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.58 9973686.0 0.13558297093229263 53.9046 39.5309 0 0 30 0 0 0 0 0 31 0 0 0 -0 MePC(34:3)+Na MePC(34:3)+Na MePC (34:3) (34:3) 792.55137847 C43 H80 O8 N1 P1 Na1 2674428.9 1228428.217 6.441584319850043 3.762496715418599 10.100362142876332 0.99 122.12717650177571 0.0 0.0 2535811.144 0.0 0.0 0.0 0.0 0.0 2674428.9 0.0 0.0 0.0 0.0 0.0 1064655.393 0.0 0.0 0.0 0.0 0.0 1228428.217 0.0 0.0 0.0 6.439 6.441 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2173 -2172 1524 -2171 -2170 -2169 -2168 -2167 1622 -2166 -2165 -2164 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 792.554939 792.553071 6.441584319850043 6.441584319850043 6.439 6.441584319850043 6.441584319850043 6.441584319850043 6.441584319850043 6.441584319850043 6.441 6.441584319850043 6.441584319850043 6.441584319850043 904504.4375 1165703.25 1 1 1 1 1 1 1 1 1 1 1 1 792.55137847 792.55137847 0.003560529999958817 792.55137847 792.55137847 792.55137847 792.55137847 792.55137847 0.0016925300000139032 792.55137847 792.55137847 792.55137847 1000000.0 1000000.0 4.492491082196246 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.1355460932782537 1000000.0 1000000.0 1000000.0 0.0 0.0 36.41475550386277 0.0 0.0 0.0 0.0 0.0 34.66734407476912 0.0 0.0 0.0 C C 0.0 0.0 72.82951100772554 0.0 0.0 0.0 0.0 0.0 69.33468814953824 0.0 0.0 0.0 0.98 0.99 309.5660838470737 122.12717650177571 48.0337 41.756 0 0 8 0 0 0 0 0 8 0 0 0 -0 MePC(34:5)+Na MePC(34:5)+Na MePC (34:5) (34:5) 788.52007847 C43 H76 O8 N1 P1 Na1 2.0640702572E7 5130394.818 8.176 5.556430794042147 4.595944713265753 0.96 35.34077891480837 0.0 0.0 2.0640702572E7 0.0 0.0 0.0 0.0 0.0 1.9080077151E7 0.0 0.0 0.0 0.0 0.0 5130394.818 0.0 0.0 0.0 0.0 0.0 4807432.939 0.0 0.0 0.0 8.179 8.186 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.93 0.92 -2184 -2183 2312 -2182 -2181 -2180 -2179 -2178 -2177 -2176 -2175 -2174 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 788.516462 788.52008 8.176 8.176 8.179 8.176 8.176 8.176 8.176 8.176 8.186 8.176 8.176 8.176 5444933.5 1 1 1 1 1 1 1 1 1 1 1 1 788.52007847 788.52007847 0.003616469999997207 788.52007847 788.52007847 788.52007847 788.52007847 788.52007847 1.5299999631679384E-6 788.52007847 788.52007847 788.52007847 1000000.0 1000000.0 4.586401917646031 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0019403436956693153 1000000.0 1000000.0 1000000.0 0.0 0.0 7.03839641259991 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 35.19198206299955 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 1.0 35.34077891480837 55.56975894519651 8.3066 13.0696 0 0 13 0 0 0 0 0 11 0 0 0 -0 MePC(34:9)+Na MePC(34:9)+Na MePC (34:9) (34:9) 780.4574784700001 C43 H68 O8 N1 P1 Na1 4414546.11 3205067.514 6.739386004747551 2.571019610173516 0.39575525590949107 0.99 3131030.25 0.0 0.0 4256900.477 0.0 0.0 0.0 0.0 0.0 4414546.11 0.0 0.0 0.0 0.0 0.0 3205067.514 0.0 0.0 0.0 0.0 0.0 3187179.372 0.0 0.0 0.0 6.74 6.738 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2205 -2204 1652 -2203 -2202 -2201 -2200 -2199 1747 -2198 -2197 -2196 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.458222 780.45527 6.739386004747551 6.739386004747551 6.74 6.739386004747551 6.739386004747551 6.739386004747551 6.739386004747551 6.739386004747551 6.738 6.739386004747551 6.739386004747551 6.739386004747551 1179896.75 2449999.25 1 1 1 1 1 1 1 1 1 1 1 1 780.4574784700001 780.4574784700001 7.435299999087874E-4 780.4574784700001 780.4574784700001 780.4574784700001 780.4574784700001 780.4574784700001 0.0022084700000277735 780.4574784700001 780.4574784700001 780.4574784700001 1000000.0 1000000.0 0.952684829628893 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.829712138010687 1000000.0 1000000.0 1000000.0 0.0 0.0 11.368678455685886 0.0 0.0 0.0 0.0 0.0 11.566717380104484 0.0 0.0 0.0 C C 0.0 0.0 56.84339227842943 0.0 0.0 0.0 0.0 0.0 57.83358690052241 0.0 0.0 0.0 0.99 0.99 3150286.25 3131030.25 6.3966 2.4958 0 0 5 0 0 0 0 0 4 0 0 0 -0 MePC(35:1)+Na MePC(35:1)+Na MePC (35:1) (35:1) 810.5983284700001 C44 H86 O8 N1 P1 Na1 5.15902582001E8 7.5375001678E7 8.046 0.9788238171482601 1.2554238288431354 0.87 62.35085236079442 0.0 0.0 5.15902582001E8 0.0 0.0 0.0 0.0 0.0 5.08810207056E8 0.0 0.0 0.0 0.0 0.0 7.5375001678E7 0.0 0.0 0.0 0.0 0.0 7.4048540944E7 0.0 0.0 0.0 8.03 8.046 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2216 -2215 -2214 -2213 -2212 -2211 -2210 -2209 2299 -2208 -2207 -2206 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 810.59833 810.595977 8.046 8.046 8.03 8.046 8.046 8.046 8.046 8.046 8.046 8.046 8.046 8.046 981943.625 1 1 1 1 1 1 1 1 1 1 1 1 810.5983284700001 810.5983284700001 1.5299999631679384E-6 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 810.5983284700001 0.0023514700001214806 810.5983284700001 810.5983284700001 810.5983284700001 1000000.0 1000000.0 0.0018874945943397209 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.900906549560579 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.417893942183492 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 47.08946971091746 0.0 0.0 0.0 0.87 0.92 62.35085236079442 188.91704860495437 9.17 18.8768 0 0 31 0 0 0 0 0 32 0 0 0 -0 MePC(36:7e)+Na MePC(36:7e)+Na MePC (36:7e) (36:7e) 798.5408134700001 C45 H78 O7 N1 P1 Na1 2.1101721836E7 3408484.679 8.298003154963812 4.364426608655268 3.7315467701086966 0.81 11.83192548704158 0.0 0.0 1.983826645E7 0.0 0.0 0.0 0.0 0.0 2.1101721836E7 0.0 0.0 0.0 0.0 0.0 3233236.1 0.0 0.0 0.0 0.0 0.0 3408484.679 0.0 0.0 0.0 8.3 8.307 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2248 -2247 2342 -2246 -2245 -2244 -2243 -2242 2442 -2241 -2240 -2239 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 798.54188 798.539989 8.298003154963812 8.298003154963812 8.3 8.298003154963812 8.298003154963812 8.298003154963812 8.298003154963812 8.298003154963812 8.307 8.298003154963812 8.298003154963812 8.298003154963812 2147900.5 2553687.75 1 1 1 1 1 1 1 1 1 1 1 1 798.5408134700001 798.5408134700001 0.0010665299998890987 798.5408134700001 798.5408134700001 798.5408134700001 798.5408134700001 798.5408134700001 8.244700001114325E-4 798.5408134700001 798.5408134700001 798.5408134700001 1000000.0 1000000.0 1.335598609236479 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0324707093288807 1000000.0 1000000.0 1000000.0 0.0 0.0 10.906402688577053 0.0 0.0 0.0 0.0 0.0 10.950587740915385 0.0 0.0 0.0 C C 0.0 0.0 54.532013442885265 0.0 0.0 0.0 0.0 0.0 54.75293870457693 0.0 0.0 0.0 0.94 0.81 25.949155705346186 11.83192548704158 5.1056 5.9413 0 0 23 0 0 0 0 0 25 0 0 0 -0 MePC(37:5)+Na MePC(37:5)+Na MePC (37:5) (37:5) 830.5670284700001 C46 H82 O8 N1 P1 Na1 9.1405896074E7 1.9530784533E7 7.69 1.463301399701334 2.56241908658942 0.97 32.0794837164021 0.0 0.0 8.9533695407E7 0.0 0.0 0.0 0.0 0.0 9.1405896074E7 0.0 0.0 0.0 0.0 0.0 1.9530784533E7 0.0 0.0 0.0 0.0 0.0 1.883562211E7 0.0 0.0 0.0 7.693 7.689 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2259 -2258 -2257 -2256 -2255 -2254 -2253 -2252 2161 -2251 -2250 -2249 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 830.56703 830.564357 7.69 7.69 7.693 7.69 7.69 7.69 7.69 7.69 7.689 7.69 7.69 7.69 2760521.5 1 1 1 1 1 1 1 1 1 1 1 1 830.5670284700001 830.5670284700001 1.5299999631679384E-6 830.5670284700001 830.5670284700001 830.5670284700001 830.5670284700001 830.5670284700001 0.002671470000109366 830.5670284700001 830.5670284700001 830.5670284700001 1000000.0 1000000.0 0.001842114977747641 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.2164411884138007 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.505737542714255 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 37.52868771357127 0.0 0.0 0.0 0.95 0.97 37.25802626760565 32.0794837164021 12.6734 7.4553 0 0 23 0 0 0 0 0 23 0 0 0 -0 PC(18:5e)+H PC(18:5e)+H PC (18:5e) (18:5e) 514.29281847 C26 H45 O7 N1 P1 4172008.468 777624.374 1.309 30.351913442738393 13.110731579545249 0.96 710593.69 0.0 0.0 2697641.238 0.0 0.0 0.0 0.0 0.0 4172008.468 0.0 0.0 0.0 0.0 0.0 777624.374 0.0 0.0 0.0 0.0 0.0 645674.763 0.0 0.0 0.0 1.326 1.313 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.062 0.0 0.0 0.0 1.0 0.56 -2270 -2269 204 -2268 -2267 -2266 -2265 -2264 -2263 -2262 -2261 -2260 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 514.290649 514.29282 1.309 1.309 1.326 1.309 1.309 1.309 1.309 1.309 1.313 1.309 1.309 1.309 330345.21875 1 1 1 1 1 1 1 1 1 1 1 1 514.29281847 514.29281847 0.002169470000012552 514.29281847 514.29281847 514.29281847 514.29281847 514.29281847 1.5299999631679384E-6 514.29281847 514.29281847 514.29281847 1000000.0 1000000.0 4.21835561784945 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002974958833218059 1000000.0 1000000.0 1000000.0 0.0 0.0 5.186975397645912 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 25.70386270985828 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.96 39.19594116027982 710593.69 4.0123 7.3421 0 0 17 0 0 0 0 0 26 0 0 0 -0 PC(19:3)+H PC(19:3)+H PC (19:3) (19:3) 546.3190334700001 C27 H49 O8 N1 P1 1.9241463131E7 1779234.354 0.8934737467548826 11.971831667676943 2.188944441926089 0.97 54.56983856120507 0.0 0.0 1.6237997843E7 0.0 0.0 0.0 0.0 0.0 1.9241463131E7 0.0 0.0 0.0 0.0 0.0 1779234.354 0.0 0.0 0.0 0.0 0.0 1724995.276 0.0 0.0 0.0 0.891 0.893 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2280 -2279 80 -2278 -2277 -2276 -2275 -2274 102 -2273 -2272 -2271 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 546.319404 546.319452 0.8934737467548826 0.8934737467548826 0.891 0.8934737467548826 0.8934737467548826 0.8934737467548826 0.8934737467548826 0.8934737467548826 0.893 0.8934737467548826 0.8934737467548826 0.8934737467548826 221289.21875 423505.6875 1 1 1 1 1 1 1 1 1 1 1 1 546.3190334700001 546.3190334700001 3.7052999982734036E-4 546.3190334700001 546.3190334700001 546.3190334700001 546.3190334700001 546.3190334700001 4.1852999981983885E-4 546.3190334700001 546.3190334700001 546.3190334700001 1000000.0 1000000.0 0.6782300764333286 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7660908263830817 1000000.0 1000000.0 1000000.0 0.0 0.0 7.178138466718796 0.0 0.0 0.0 0.0 0.0 8.137176170210115 0.0 0.0 0.0 C C 0.0 0.0 36.1019072762227 0.0 0.0 0.0 0.0 0.0 26.157740858181196 0.0 0.0 0.0 0.96 0.97 27.106844343852316 54.56983856120507 5.5612 6.3506 0 0 37 0 0 0 0 0 60 0 0 0 -0 PC(22:3)+H PC(22:3)+H PC (22:3) (22:3) 588.3659834700001 C30 H55 O8 N1 P1 2978144.347 289834.559 0.955 16.875899592604203 4.742637865709464 0.57 30.346697687881854 0.0 0.0 2343150.838 0.0 0.0 0.0 0.0 0.0 2978144.347 0.0 0.0 0.0 0.0 0.0 289834.559 0.0 0.0 0.0 0.0 0.0 271025.818 0.0 0.0 0.0 0.957 0.964 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2291 -2290 150 -2289 -2288 -2287 -2286 -2285 -2284 -2283 -2282 -2281 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 588.365834 588.36598 0.955 0.955 0.957 0.955 0.955 0.955 0.955 0.955 0.964 0.955 0.955 0.955 278907.375 1 1 1 1 1 1 1 1 1 1 1 1 588.3659834700001 588.3659834700001 1.4947000011034106E-4 588.3659834700001 588.3659834700001 588.3659834700001 588.3659834700001 588.3659834700001 3.470000024208275E-6 588.3659834700001 588.3659834700001 588.3659834700001 1000000.0 1000000.0 0.25404255906980444 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005897689740224769 1000000.0 1000000.0 1000000.0 0.0 0.0 22.200054704021262 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 55.22401667666983 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 0.57 15.264534586321247 30.346697687881854 3.5756 6.9501 0 0 30 0 0 0 0 0 59 0 0 0 -0 PC(28:0)+H PC(28:0)+H PC (28:0) (28:0) 678.5068334700001 C36 H73 O8 N1 P1 1.9101048527E7 4401197.745 7.296682844217588 0.1248767032956737 5.291610559447996 0.93 4.389393702164162 0.0 0.0 1.9067345391E7 0.0 0.0 0.0 0.0 0.0 1.9101048527E7 0.0 0.0 0.0 0.0 0.0 4401197.745 0.0 0.0 0.0 0.0 0.0 4083714.908 0.0 0.0 0.0 7.301 7.296 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2301 -2300 1891 -2299 -2298 -2297 -2296 -2295 1995 -2294 -2293 -2292 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 678.506962 678.506521 7.296682844217588 7.296682844217588 7.301 7.296682844217588 7.296682844217588 7.296682844217588 7.296682844217588 7.296682844217588 7.296 7.296682844217588 7.296682844217588 7.296682844217588 3417773.25 3840873.75 1 1 1 1 1 1 1 1 1 1 1 1 678.5068334700001 678.5068334700001 1.2852999998358428E-4 678.5068334700001 678.5068334700001 678.5068334700001 678.5068334700001 678.5068334700001 3.1247000003986614E-4 678.5068334700001 678.5068334700001 678.5068334700001 1000000.0 1000000.0 0.18943066398647726 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4605259440672706 1000000.0 1000000.0 1000000.0 0.0 0.0 18.135141902275453 0.0 0.0 0.0 0.0 0.0 18.294575856688777 0.0 0.0 0.0 C C 0.0 0.0 60.42763133555098 0.0 0.0 0.0 0.0 0.0 60.9588770391453 0.0 0.0 0.0 0.93 0.93 5.597492561483291 4.389393702164162 5.9555 8.2626 0 0 23 0 0 0 0 0 21 0 0 0 -0 PC(29:0)+H PC(29:0)+H PC (29:0) (29:0) 692.5224834700001 C37 H75 O8 N1 P1 1.0895006565E7 2331588.0 7.547816723264669 15.36162588112825 11.51042059100285 0.87 2421264.25 0.0 0.0 1.0895006565E7 0.0 0.0 0.0 0.0 0.0 8760017.007299988 0.0 0.0 0.0 0.0 0.0 1980613.741 0.0 0.0 0.0 0.0 0.0 2331588.0 0.0 0.0 0.0 7.555 7.538 0.0 0.0 0.046 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 0.84 -2322 -2321 2028 -2320 -2319 -2318 -2317 -2316 2109 -2315 -2314 -2313 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 692.523062 692.521505 7.547816723264669 7.547816723264669 7.555 7.547816723264669 7.547816723264669 7.547816723264669 7.547816723264669 7.547816723264669 7.538 7.547816723264669 7.547816723264669 7.547816723264669 1653684.5 2284355.75 1 1 1 1 1 1 1 1 1 1 1 1 692.5224834700001 692.5224834700001 5.78529999870625E-4 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 9.784700000636803E-4 692.5224834700001 692.5224834700001 692.5224834700001 1000000.0 1000000.0 0.8353952596193027 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.412907195678171 1000000.0 1000000.0 1000000.0 0.0 0.0 25.99330178764087 0.0 0.0 0.0 0.0 0.0 25.155682850949397 0.0 0.0 0.0 C C 0.0 0.0 64.8212014654386 0.0 0.0 0.0 0.0 0.0 62.732376186906244 0.0 0.0 0.0 0.87 0.6416726505891456 2421264.25 6.443072450972944 3.6544 2.821 0 0 12 0 0 0 0 0 11 0 0 0 -0 PC(29:2)+H PC(29:2)+H PC (29:2) (29:2) 688.4911834700001 C37 H71 O8 N1 P1 5.8579775172E7 1.8132794961E7 7.443 5.262340004077984 11.922139881416363 0.96 2.1260344E7 0.0 0.0 5.4376626462E7 0.0 0.0 0.0 0.0 0.0 5.8579775172E7 0.0 0.0 0.0 0.0 0.0 1.5313220301E7 0.0 0.0 0.0 0.0 0.0 1.8132794961E7 0.0 0.0 0.0 7.441 7.44 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.9 0.93 -2333 -2332 1982 -2331 -2330 -2329 -2328 -2327 -2326 -2325 -2324 -2323 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 688.490933 688.49118 7.443 7.443 7.441 7.443 7.443 7.443 7.443 7.443 7.44 7.443 7.443 7.443 3453837.0 1 1 1 1 1 1 1 1 1 1 1 1 688.4911834700001 688.4911834700001 2.5047000008271425E-4 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 3.470000137895113E-6 688.4911834700001 688.4911834700001 688.4911834700001 1000000.0 1000000.0 0.3637955083467355 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005040006642360022 1000000.0 1000000.0 1000000.0 0.0 0.0 18.00158119094057 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 59.390663662667286 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.96 1.709399E7 2.1260344E7 9.3662 10.0907 0 0 9 0 0 0 0 0 8 0 0 0 -0 PC(30:0)+H PC(30:0)+H PC (30:0) (30:0) 706.5381334700002 C38 H77 O8 N1 P1 3.56741641214E8 7.6403759039E7 7.819522457075694 13.244910595002093 10.656694463680635 0.98 113.15934860924878 0.0 0.0 2.95642201237E8 0.0 0.0 0.0 0.0 0.0 3.56741641214E8 0.0 0.0 0.0 0.0 0.0 6.5695947988E7 0.0 0.0 0.0 0.0 0.0 7.6403759039E7 0.0 0.0 0.0 7.821 7.822 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 -2343 -2342 2198 -2341 -2340 -2339 -2338 -2337 2295 -2336 -2335 -2334 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 706.537582 706.537694 7.819522457075694 7.819522457075694 7.821 7.819522457075694 7.819522457075694 7.819522457075694 7.819522457075694 7.819522457075694 7.822 7.819522457075694 7.819522457075694 7.819522457075694 4091028.75 4539555.0 1 1 1 1 1 1 1 1 1 1 1 1 706.5381334700002 706.5381334700002 5.514700001185702E-4 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 706.5381334700002 4.394700001739693E-4 706.5381334700002 706.5381334700002 706.5381334700002 1000000.0 1000000.0 0.7805240425030587 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6220046439894378 1000000.0 1000000.0 1000000.0 0.0 0.0 25.170315795106827 0.0 0.0 0.0 0.0 0.0 25.634208561058212 0.0 0.0 0.0 C C 0.0 0.0 62.76886731946841 0.0 0.0 0.0 0.0 0.0 63.925707134808526 0.0 0.0 0.0 0.97 0.98 7.0200472E7 113.15934860924878 15.3725 19.5856 0 0 21 0 0 0 0 0 20 0 0 0 -0 PC(30:1)+H PC(30:1)+H PC (30:1) (30:1) 704.5224834700001 C38 H75 O8 N1 P1 2.94579557392E8 5.003853857E7 7.390236589819779 4.18136970235774 4.4987016597605445 0.81 77.49804482486415 0.0 0.0 2.77660285747E8 0.0 0.0 0.0 0.0 0.0 2.94579557392E8 0.0 0.0 0.0 0.0 0.0 4.6953171695E7 0.0 0.0 0.0 0.0 0.0 5.003853857E7 0.0 0.0 0.0 7.398 7.383 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2353 -2352 1917 -2351 -2350 -2349 -2348 -2347 2019 -2346 -2345 -2344 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 704.522447 704.522415 7.390236589819779 7.390236589819779 7.398 7.390236589819779 7.390236589819779 7.390236589819779 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702.5068334700001 702.5068334700001 6.425299999364142E-4 702.5068334700001 702.5068334700001 702.5068334700001 702.5068334700001 702.5068334700001 0.0016305299999430645 702.5068334700001 702.5068334700001 702.5068334700001 1000000.0 1000000.0 0.9146245549849913 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.32101656846402 1000000.0 1000000.0 1000000.0 0.0 0.0 19.11613534460645 0.0 0.0 0.0 0.0 0.0 19.04245809691181 0.0 0.0 0.0 C C 0.0 0.0 63.69637389048696 0.0 0.0 0.0 0.0 0.0 63.45087586320375 0.0 0.0 0.0 0.89 0.93 33.2123235885005 37.80567928283537 4.693 6.9732 0 0 32 0 0 0 0 0 33 0 0 0 -0 PC(30:3)+H PC(30:3)+H PC (30:3) (30:3) 700.4911834700001 C38 H71 O8 N1 P1 7.0260071571E7 1.2974850582E7 6.537444542338818 0.9165338736910897 1.6460631545401752 0.99 46.39585346714516 0.0 0.0 7.0260071571E7 0.0 0.0 0.0 0.0 0.0 6.9355242428E7 0.0 0.0 0.0 0.0 0.0 1.2676286121E7 0.0 0.0 0.0 0.0 0.0 1.2974850582E7 0.0 0.0 0.0 6.542 6.536 0.0 0.0 0.046 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 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734.56943347 734.56943347 734.56943347 734.56943347 734.56943347 1.304700000446246E-4 734.56943347 734.56943347 734.56943347 1000000.0 1000000.0 0.004723855725682044 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.17761425142386222 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.88755025402951 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.06371634421326 0.0 0.0 0.0 0.7381573291327013 0.6372867849469835 298.3241198960388 464.8955785323794 6.1996 6.6458 0 0 27 0 0 0 0 0 27 0 0 0 -0 PC(32:0e)+H PC(32:0e)+H PC (32:0e) (32:0e) 720.5901684700001 C40 H83 O7 N1 P1 2.2558703689E7 3290223.982 8.621830461755533 5.238021771764019 8.09457976896066 0.83 13.781034785856264 0.0 0.0 2.0947310232E7 0.0 0.0 0.0 0.0 0.0 2.2558703689E7 0.0 0.0 0.0 0.0 0.0 2933967.904 0.0 0.0 0.0 0.0 0.0 3290223.982 0.0 0.0 0.0 8.615 8.625 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -2530 -2529 2510 -2528 -2527 -2526 -2525 -2524 2598 -2523 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0.0 0.0 58.70476673326499 0.0 0.0 0.0 0.98 0.98 190.35112850475613 177.78547325988046 18.4641 25.1704 0 0 34 0 0 0 0 0 33 0 0 0 -0 PC(36:2)+Na PC(36:2)+Na PC (36:2) (36:2) 808.5826784700001 C44 H84 O8 N1 P1 Na1 2.84183730792E8 3.9550494685E7 8.352638141564533 11.965670794309926 0.031839714724250595 0.98 20.298322648587636 0.0 0.0 2.39845574775E8 0.0 0.0 0.0 0.0 0.0 2.84183730792E8 0.0 0.0 0.0 0.0 0.0 3.9550494685E7 0.0 0.0 0.0 0.0 0.0 3.9532689835E7 0.0 0.0 0.0 8.347 8.355 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.059 0.0 0.0 0.0 0.0 0.0 0.048 0.0 0.0 0.0 0.0 0.0 0.054 0.0 0.0 0.0 0.82 0.87 -3749 -3748 -3747 -3746 -3745 -3744 -3743 -3742 2438 -3741 -3740 -3739 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.58268 808.581782 8.352638141564533 8.352638141564533 8.347 8.352638141564533 8.352638141564533 8.352638141564533 8.352638141564533 8.352638141564533 8.355 8.352638141564533 8.352638141564533 8.352638141564533 9812902.0 1 1 1 1 1 1 1 1 1 1 1 1 808.5826784700001 808.5826784700001 1.5299998494811007E-6 808.5826784700001 808.5826784700001 808.5826784700001 808.5826784700001 808.5826784700001 8.964700001570236E-4 808.5826784700001 808.5826784700001 808.5826784700001 1000000.0 1000000.0 0.0018921996355105775 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1086930551781344 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.113226260763817 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 64.67275325004445 0.0 0.0 0.0 0.98 0.98 4.924079550256132 20.298322648587636 5.6132 6.0593 0 0 31 0 0 0 0 0 30 0 0 0 -0 PC(36:3)+H PC(36:3)+H PC (36:3) (36:3) 784.5850834700001 C44 H83 O8 N1 P1 6.845974527777E9 7.13404637277E8 8.034842482888967 1.4224540539175414 0.7808364670518072 0.85 57.82332268651664 0.0 0.0 6.709628623811E9 0.0 0.0 0.0 0.0 0.0 6.845974527777E9 0.0 0.0 0.0 0.0 0.0 7.13404637277E8 0.0 0.0 0.0 0.0 0.0 7.05569985139E8 0.0 0.0 0.0 8.03 8.042 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -3759 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7.609931000526578 7.609931000526578 7.642 7.609931000526578 7.609931000526578 7.609931000526578 7.609931000526578 7.609931000526578 7.649 7.609931000526578 7.609931000526578 7.609931000526578 1.1093788E7 1 1 1 1 1 1 1 1 1 1 1 1 804.55137847 804.55137847 1.5299999631679384E-6 804.55137847 804.55137847 804.55137847 804.55137847 804.55137847 1.6047000008256873E-4 804.55137847 804.55137847 804.55137847 1000000.0 1000000.0 0.001901680867264823 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.19945276880605373 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 23.63594675127852 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 58.07357924147058 0.0 0.0 0.0 0.95 0.96 43.990848608868276 56.530307020529385 9.7155 10.914 0 0 31 0 0 0 0 0 32 0 0 0 -0 PC(36:4)+H PC(36:4)+H PC (36:4) (36:4) 782.56943347 C44 H81 O8 N1 P1 9.80315808056E8 1.05102032527E8 8.293000000000001 137.2330347151834 107.28170692932362 0.96 16.790410590740503 0.0 0.0 1.4734660319999708E7 0.0 0.0 0.0 0.0 0.0 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0.0022054700001490346 768.5901684700001 768.5901684700001 768.5901684700001 768.5901684700001 768.5901684700001 0.0014844700001503952 768.5901684700001 768.5901684700001 768.5901684700001 1000000.0 1000000.0 2.869500665796142 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.9314194495949213 1000000.0 1000000.0 1000000.0 0.0 0.0 24.672036419856777 0.0 0.0 0.0 0.0 0.0 23.42900122528458 0.0 0.0 0.0 C C 0.0 0.0 61.52627536123886 0.0 0.0 0.0 0.0 0.0 58.4264369707845 0.0 0.0 0.0 0.94 0.9 207.31944988670466 115.55894835896939 6.4534 7.429 0 0 20 0 0 0 0 0 20 0 0 0 -0 PC(36:5)+H PC(36:5)+H PC (36:5) (36:5) 780.55378347 C44 H79 O8 N1 P1 1.5009897353711E10 2.30138308046E9 7.206271743507032 1.9324483102505965 2.8973333054947217 0.93 14113.876314169991 0.0 0.0 1.460522234882E10 0.0 0.0 0.0 0.0 0.0 1.5009897353711E10 0.0 0.0 0.0 0.0 0.0 2.208978224667E9 0.0 0.0 0.0 0.0 0.0 2.30138308046E9 0.0 0.0 0.0 7.2 7.203 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4040 -4039 -4038 -4037 -4036 -4035 -4034 -4033 1930 -4032 -4031 -4030 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.55378 780.552543 7.206271743507032 7.206271743507032 7.2 7.206271743507032 7.206271743507032 7.206271743507032 7.206271743507032 7.206271743507032 7.203 7.206271743507032 7.206271743507032 7.206271743507032 2.10432384E8 1 1 1 1 1 1 1 1 1 1 1 1 780.55378347 780.55378347 3.470000024208275E-6 780.55378347 780.55378347 780.55378347 780.55378347 780.55378347 0.0012404699999706281 780.55378347 780.55378347 780.55378347 1000000.0 1000000.0 0.004445561725141061 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5892178428192896 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.67080448185429 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 64.01696878267904 0.0 0.0 0.0 0.88 0.93 2333.2238864723467 14113.876314169991 1350.006 1392.9144 0 0 34 0 0 0 0 0 35 0 0 0 -0 PC(36:5)+Na PC(36:5)+Na PC (36:5) (36:5) 802.53572847 C44 H78 O8 N1 P1 Na1 7.13126354013E8 8.214512562E7 7.206271743507032 10.503850502576222 3.5298808268314352 0.69 50.26338814639349 0.0 0.0 6.14517666584E8 0.0 0.0 0.0 0.0 0.0 7.13126354013E8 0.0 0.0 0.0 0.0 0.0 8.214512562E7 0.0 0.0 0.0 0.0 0.0 7.8144297344E7 0.0 0.0 0.0 7.193 7.183 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4050 -4049 1868 -4048 -4047 -4046 -4045 -4044 1965 -4043 -4042 -4041 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 802.534542 802.533387 7.206271743507032 7.206271743507032 7.193 7.206271743507032 7.206271743507032 7.206271743507032 7.206271743507032 7.206271743507032 7.183 7.206271743507032 7.206271743507032 7.206271743507032 7.1183528E7 7.2785992E7 1 1 1 1 1 1 1 1 1 1 1 1 802.53572847 802.53572847 0.0011864699999932782 802.53572847 802.53572847 802.53572847 802.53572847 802.53572847 0.0023414700000330413 802.53572847 802.53572847 802.53572847 1000000.0 1000000.0 1.4784014691224183 1000000.0 1000000.0 1000000.0 1000000.0 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7.236 7.206271743507032 7.206271743507032 7.206271743507032 1896608.25 1800558.375 1 1 1 1 1 1 1 1 1 1 1 1 818.50966647 818.50966647 7.545299999947019E-4 818.50966647 818.50966647 818.50966647 818.50966647 818.50966647 3.2469999950990314E-5 818.50966647 818.50966647 818.50966647 1000000.0 1000000.0 0.9218339512699658 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.039669659725613524 1000000.0 1000000.0 1000000.0 0.0 0.0 11.98997206435032 0.0 0.0 0.0 0.0 0.0 12.142198990002035 0.0 0.0 0.0 C C 0.0 0.0 59.35629734826894 0.0 0.0 0.0 0.0 0.0 59.81378812808886 0.0 0.0 0.0 0.51 0.88 9.792548330606628 20.29089411964706 6.8282 6.3052 0 0 26 0 0 0 0 0 24 0 0 0 -0 PC(36:5)+Na PC(36:5)+Na PC (36:5) (36:5) 802.53572847 C44 H78 O8 N1 P1 Na1 9.3000129692E7 1.6731172681E7 7.369 119.27139305884484 81.25282174017006 0.91 11.564834101857173 0.0 0.0 9.3000129692E7 0.0 0.0 0.0 0.0 0.0 7901828.699999925 0.0 0.0 0.0 0.0 0.0 1.6731172681E7 0.0 0.0 0.0 0.0 0.0 4520911.0 0.0 0.0 0.0 7.373 7.373 0.0 0.0 0.0 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6.802188365537364 6.795 6.802188365537364 6.802188365537364 6.802188365537364 2.544567552E9 2.659666176E9 1 1 1 1 1 1 1 1 1 1 1 1 778.5381334700002 778.5381334700002 2.4529999791411683E-5 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 778.5381334700002 3.015299998878618E-4 778.5381334700002 778.5381334700002 778.5381334700002 1000000.0 1000000.0 0.03150776915971954 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3873028011408009 1000000.0 1000000.0 1000000.0 0.0 0.0 25.626404043391513 0.0 0.0 0.0 0.0 0.0 25.539611371458992 0.0 0.0 0.0 C C 0.0 0.0 63.90624449723571 0.0 0.0 0.0 0.0 0.0 63.68980391885037 0.0 0.0 0.0 0.8919833795365886 0.88 5543.717347209006 242.21297174304095 8.385 29.1717 0 0 28 0 0 0 0 0 25 0 0 0 -0 PC(36:6)+Na PC(36:6)+Na PC (36:6) (36:6) 800.5200784700002 C44 H76 O8 N1 P1 Na1 9.68136848182E8 1.28492535433E8 6.802188365537364 1.194829841102456 3.5340309787744517 0.91 75.87285729477715 0.0 0.0 9.51914863451E8 0.0 0.0 0.0 0.0 0.0 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1 1 1 1 1 1 1 1 816.4940164700001 816.4940164700001 1.8147000014323567E-4 816.4940164700001 816.4940164700001 816.4940164700001 816.4940164700001 816.4940164700001 0.0026224700001193924 816.4940164700001 816.4940164700001 816.4940164700001 1000000.0 1000000.0 0.2222551500472671 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.2118667708763886 1000000.0 1000000.0 1000000.0 0.0 0.0 11.174012073966896 0.0 0.0 0.0 0.0 0.0 13.509639077195665 0.0 0.0 0.0 C C 0.0 0.0 55.31689145528169 0.0 0.0 0.0 0.0 0.0 65.58077221939647 0.0 0.0 0.0 0.81 0.98 3.146948796180035 97.62367161500626 5.9738 13.0338 0 0 22 0 0 0 0 0 26 0 0 0 -0 PC(36:6)+Na PC(36:6)+Na PC (36:6) (36:6) 800.5200784700002 C44 H76 O8 N1 P1 Na1 4.2354555543E7 1.158560639E7 7.043 11.552168126240755 7.6936550306549485 0.92 6.370516362849324 0.0 0.0 3.5957540784E7 0.0 0.0 0.0 0.0 0.0 4.2354555543E7 0.0 0.0 0.0 0.0 0.0 1.0390077407E7 0.0 0.0 0.0 0.0 0.0 1.158560639E7 0.0 0.0 0.0 7.05 7.043 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 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6.487669665295959 6.487669665295959 6.491 6.487669665295959 6.487669665295959 6.487669665295959 943507.6875 1834082.0 1 1 1 1 1 1 1 1 1 1 1 1 776.5224834700001 776.5224834700001 5.524700001160454E-4 776.5224834700001 776.5224834700001 776.5224834700001 776.5224834700001 776.5224834700001 1.6052999990279204E-4 776.5224834700001 776.5224834700001 776.5224834700001 1000000.0 1000000.0 0.711466843364606 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.20672936498302164 1000000.0 1000000.0 1000000.0 0.0 0.0 23.076937149173673 0.0 0.0 0.0 0.0 0.0 25.529048548516172 0.0 0.0 0.0 C C 0.0 0.0 57.54847169369995 0.0 0.0 0.0 0.0 0.0 63.66346271450419 0.0 0.0 0.0 0.88 0.96 18.55819017168885 1.2891291561564782 5.3059 5.1608 0 0 28 0 0 0 0 0 17 0 0 0 -0 PC(36:7)+H PC(36:7)+H PC (36:7) (36:7) 776.5224834700001 C44 H75 O8 N1 P1 1.98069760033E8 5.1514567422E7 7.115498445539029 3.6218668903709053 17.107174228320407 0.96 14.485535843449446 0.0 0.0 1.88177780382E8 0.0 0.0 0.0 0.0 0.0 1.98069760033E8 0.0 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8.023 8.023 8.047 8.023 8.023 8.023 8.023 8.023 8.026 8.023 8.023 8.023 1453848.375 1 1 1 1 1 1 1 1 1 1 1 1 832.5850834700001 832.5850834700001 0.00240347000010388 832.5850834700001 832.5850834700001 832.5850834700001 832.5850834700001 832.5850834700001 0.002836529999967752 832.5850834700001 832.5850834700001 832.5850834700001 1000000.0 1000000.0 2.886756017879682 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.406895050468387 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.539121501327144 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 36.47933258085127 0.0 0.0 0.0 0.71 0.61 7.8689963756431185 14.70310434588293 5.9083 5.2033 0 0 24 0 0 0 0 0 30 0 0 0 -0 PC(40:8)+H PC(40:8)+H PC (40:8) (40:8) 830.56943347 C48 H81 O8 N1 P1 9.1405896074E7 1.9530784533E7 7.812 1.463301399701334 2.56241908658942 0.97 32.0794837164021 0.0 0.0 8.9533695407E7 0.0 0.0 0.0 0.0 0.0 9.1405896074E7 0.0 0.0 0.0 0.0 0.0 1.9530784533E7 0.0 0.0 0.0 0.0 0.0 1.883562211E7 0.0 0.0 0.0 7.693 7.689 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4817 -4816 -4815 -4814 -4813 -4812 -4811 -4810 2232 -4809 -4808 -4807 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 830.56703 830.565861 7.812 7.812 7.693 7.812 7.812 7.812 7.812 7.812 7.689 7.812 7.812 7.812 1417220.5 1 1 1 1 1 1 1 1 1 1 1 1 830.56943347 830.56943347 0.002403469999990193 830.56943347 830.56943347 830.56943347 830.56943347 830.56943347 0.0035724699999946097 830.56943347 830.56943347 830.56943347 1000000.0 1000000.0 2.893761681005813 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.301229802148319 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.595054345777758 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 42.60303715684688 0.0 0.0 0.0 0.95 0.97 37.25802626760565 32.0794837164021 12.6734 7.4553 0 0 23 0 0 0 0 0 23 0 0 0 -0 PC(40:9)+H PC(40:9)+H PC (40:9) (40:9) 828.55378347 C48 H79 O8 N1 P1 5402517.752 1735473.63 6.935 12.120837123492837 21.12145077125699 0.87 7.655479498830671 0.0 0.0 5402517.752 0.0 0.0 0.0 0.0 0.0 4549553.022300004 0.0 0.0 0.0 0.0 0.0 1284445.11 0.0 0.0 0.0 0.0 0.0 1735473.63 0.0 0.0 0.0 6.939 6.934 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 1.0 -4828 -4827 -4826 -4825 -4824 -4823 -4822 -4821 1825 -4820 -4819 -4818 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 828.55378 828.551149 6.935 6.935 6.939 6.935 6.935 6.935 6.935 6.935 6.934 6.935 6.935 6.935 487848.84375 1 1 1 1 1 1 1 1 1 1 1 1 828.55378347 828.55378347 3.470000024208275E-6 828.55378347 828.55378347 828.55378347 828.55378347 828.55378347 0.0026344699999754084 828.55378347 828.55378347 828.55378347 1000000.0 1000000.0 0.004188020250991849 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.17960047076509 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.866697567095727 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.865228805336784 0.0 0.0 0.0 0.87 0.841384399377775 7.655479498830671 0.0 3.3279 4.5367 0 0 15 0 0 0 0 0 10 0 0 0 -0 PC(40:9)+H PC(40:9)+H PC (40:9) (40:9) 828.55378347 C48 H79 O8 N1 P1 1.6238378771E7 3401449.69 7.455 58.89000227393697 3.171263983716558 0.93 8.105335615722446 0.0 0.0 6690461.270400056 0.0 0.0 0.0 0.0 0.0 1.6238378771E7 0.0 0.0 0.0 0.0 0.0 3401449.69 0.0 0.0 0.0 0.0 0.0 3252245.742 0.0 0.0 0.0 7.456 7.455 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.66 0.85 -4839 -4838 -4837 -4836 -4835 -4834 -4833 -4832 2060 -4831 -4830 -4829 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 828.55378 828.550772 7.455 7.455 7.456 7.455 7.455 7.455 7.455 7.455 7.455 7.455 7.455 7.455 2781139.25 1 1 1 1 1 1 1 1 1 1 1 1 828.55378347 828.55378347 3.470000024208275E-6 828.55378347 828.55378347 828.55378347 828.55378347 828.55378347 0.0030114699999330696 828.55378347 828.55378347 828.55378347 1000000.0 1000000.0 0.004188020250991849 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.634610160514834 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 13.713827526939562 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 45.45411601551852 0.0 0.0 0.0 0.8825747714331047 0.93 0.0 8.105335615722446 4.573 7.4862 0 0 7 0 0 0 0 0 8 0 0 0 -0 PE(14:0e)+Na PE(14:0e)+Na PE (14:0e) (14:0e) 448.24346347 C19 H40 O7 N1 P1 Na1 1.0472361775E7 1897991.721 1.006 2.1501159976990167 0.4705356386120367 0.86 146.08297496891086 0.0 0.0 0.0 1.0158695108E7 0.0 0.0 0.0 0.0 0.0 1.0472361775E7 0.0 0.0 0.0 0.0 0.0 1885403.648 0.0 0.0 0.0 0.0 0.0 1897991.721 0.0 0.0 1.021 1.007 0.0 0.0 0.0 0.044 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -4861 -4860 -4859 -4858 -4857 -4856 -4855 -4854 -4853 173 -4852 -4851 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 448.24346 448.245155 1.006 1.006 1.006 1.021 1.006 1.006 1.006 1.006 1.006 1.007 1.006 1.006 1421818.75 1 1 1 1 1 1 1 1 1 1 1 1 448.24346347 448.24346347 448.24346347 3.4699999673648563E-6 448.24346347 448.24346347 448.24346347 448.24346347 448.24346347 0.001691530000016428 448.24346347 448.24346347 1000000.0 1000000.0 1000000.0 0.007741328653188706 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.7736858155649124 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.741775717434423 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 42.230800567316045 0.0 0.0 0.95 0.86 120.0186970687266 146.08297496891086 8.3516 18.3708 0 0 0 20 0 0 0 0 0 18 0 0 -0 PE(14:0e)+Na PE(14:0e)+Na PE (14:0e) (14:0e) 448.24346347 C19 H40 O7 N1 P1 Na1 2104628.576 726456.289 7.752 3.1608457661745986 6.31854124355132 0.97 149.96952797433585 0.0 0.0 0.0 2012606.097 0.0 0.0 0.0 0.0 0.0 2104628.576 0.0 0.0 0.0 0.0 0.0 664318.111 0.0 0.0 0.0 0.0 0.0 726456.289 0.0 0.0 7.753 7.759 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4872 -4871 -4870 683 -4869 -4868 -4867 -4866 -4865 -4864 -4863 -4862 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 448.245689 448.24346 7.752 7.752 7.752 7.753 7.752 7.752 7.752 7.752 7.752 7.759 7.752 7.752 219801.53125 1 1 1 1 1 1 1 1 1 1 1 1 448.24346347 448.24346347 448.24346347 0.0022255300000324496 448.24346347 448.24346347 448.24346347 448.24346347 448.24346347 3.4699999673648563E-6 448.24346347 448.24346347 1000000.0 1000000.0 1000000.0 4.965002685825891 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.007741328653188706 1000000.0 1000000.0 0.0 0.0 0.0 9.092986001750283 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 43.92746860748928 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.97 201.23756871392038 149.96952797433585 31.1735 50.1537 0 0 0 16 0 0 0 0 0 16 0 0 -0 PE(16:0e)+H PE(16:0e)+H PE (16:0e) (16:0e) 454.2928184700001 C21 H45 O7 N1 P1 5615180.899 793176.874 2.2403641080891963 21.351683085809135 20.182718582874816 0.97 50.06291593558903 0.0 0.0 3908074.902 5582554.24 0.0 0.0 0.0 0.0 3797928.44 5615180.899 0.0 0.0 0.0 0.0 543068.721 793176.874 0.0 0.0 0.0 0.0 564401.247 781932.491 0.0 0.0 2.25 2.238 2.261 2.242 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -4882 -4881 -4880 -4879 -4878 -4877 -4876 -4875 381 320 -4874 -4873 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 454.29282 454.29282 454.293127 454.29262 2.2403641080891963 2.2403641080891963 2.25 2.238 2.2403641080891963 2.2403641080891963 2.2403641080891963 2.2403641080891963 2.261 2.242 2.2403641080891963 2.2403641080891963 263661.71875 277919.03125 1 1 1 1 1 1 1 1 1 1 1 1 454.2928184700001 454.2928184700001 1.5299999063245195E-6 1.5299999063245195E-6 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 3.085299999270319E-4 1.984700001003148E-4 454.2928184700001 454.2928184700001 1000000.0 1000000.0 0.0033678716548444744 0.0033678716548444744 1000000.0 1000000.0 1000000.0 1000000.0 0.6791434673480451 0.4368768160780887 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.98164020103749 8.436565372212879 0.0 0.0 C C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 47.98865481268024 41.76517510996475 0.0 0.0 0.99 0.99 0.74 0.97 43.500417843538635 47.002200099731446 34.77427800371072 50.06291593558903 9.3225 12.2267 13.8249 11.4729 0 0 31 41 0 0 0 0 28 38 0 0 -0 PE(16:0e)+H PE(16:0e)+H PE (16:0e) (16:0e) 454.2928184700001 C21 H45 O7 N1 P1 8635652.376 1168475.36 2.458451930834453 21.863003180163055 24.70451969058835 0.99 74.73915452818238 0.0 0.0 5917656.852 8437627.447 0.0 0.0 0.0 0.0 5731055.759 8635652.376 0.0 0.0 0.0 0.0 747234.666 1158429.521 0.0 0.0 0.0 0.0 759736.062 1168475.36 0.0 0.0 2.444 2.452 2.453 2.462 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -4892 -4891 -4890 -4889 -4888 -4887 -4886 -4885 458 340 -4884 -4883 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 454.29282 454.29282 454.292877 454.292372 2.458451930834453 2.458451930834453 2.444 2.452 2.458451930834453 2.458451930834453 2.458451930834453 2.458451930834453 2.453 2.462 2.458451930834453 2.458451930834453 179331.3125 306815.84375 1 1 1 1 1 1 1 1 1 1 1 1 454.2928184700001 454.2928184700001 1.5299999063245195E-6 1.5299999063245195E-6 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 5.852999987610019E-5 4.464700000994526E-4 454.2928184700001 454.2928184700001 1000000.0 1000000.0 0.0033678716548444744 0.0033678716548444744 1000000.0 1000000.0 1000000.0 1000000.0 0.12883760758803478 0.9827802288469059 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.940863916693018 6.212823867015555 0.0 0.0 C C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 34.191447865482836 30.60504367987957 0.0 0.0 0.9 0.76 0.88 0.99 59.36460006866885 68.41013295523499 46.27482586505244 74.73915452818238 9.243 12.2267 13.8249 10.6687 0 0 34 45 0 0 0 0 33 41 0 0 -0 PE(16:0e)+H PE(16:0e)+H PE (16:0e) (16:0e) 454.2928184700001 C21 H45 O7 N1 P1 991483.771 404894.885 8.601999999999999 22.970607756888185 15.304407158578345 0.99 52.90708762657697 0.0 0.0 601010.487 949711.807 0.0 0.0 0.0 0.0 715457.672 991483.771 0.0 0.0 0.0 0.0 284821.159 356850.368 0.0 0.0 0.0 0.0 315363.864 404894.885 0.0 0.0 8.592 8.602 8.601 8.603 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -4902 -4901 -4900 718 -4899 -4898 -4897 -4896 -4895 768 -4894 -4893 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 454.29282 454.292616 454.29282 454.292806 8.601999999999999 8.601999999999999 8.592 8.602 8.601999999999999 8.601999999999999 8.601999999999999 8.601999999999999 8.601 8.603 8.601999999999999 8.601999999999999 330897.75 394196.3125 1 1 1 1 1 1 1 1 1 1 1 1 454.2928184700001 454.2928184700001 1.5299999063245195E-6 2.0247000009021576E-4 454.2928184700001 454.2928184700001 454.2928184700001 454.2928184700001 1.5299999063245195E-6 1.2470000115172297E-5 454.2928184700001 454.2928184700001 1000000.0 1000000.0 0.0033678716548444744 0.44568170981022487 1000000.0 1000000.0 1000000.0 1000000.0 0.0033678716548444744 0.02744925653275713 1000000.0 1000000.0 0.0 0.0 0.0 9.654758009810156 0.0 0.0 0.0 0.0 0.0 11.85937787987832 0.0 0.0 C C 0.0 0.0 0.0 46.41710581639498 0.0 0.0 0.0 0.0 0.0 56.47322799942057 0.0 0.0 0.99 0.98 0.98 0.99 280247.72 67.4084467497583 309697.63 52.90708762657697 2.3377 14.5187 3.278 16.8691 0 0 6 19 0 0 0 0 8 17 0 0 -0 PE(18:1e)+Na PE(18:1e)+Na PE (18:1e) (18:1e) 502.29041347000003 C23 H46 O7 N1 P1 Na1 2305783.893 300212.935 2.6994186504652937 0.9765076454218702 1.9697378643226922 0.75 81.96550929908591 0.0 0.0 2305783.893 0.0 0.0 0.0 0.0 0.0 2274159.604 0.0 0.0 0.0 0.0 0.0 300212.935 0.0 0.0 0.0 0.0 0.0 291964.992 0.0 0.0 0.0 2.693 2.702 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4953 -4952 445 -4951 -4950 -4949 -4948 -4947 -4946 -4945 -4944 -4943 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 502.290531 502.29041 2.6994186504652937 2.6994186504652937 2.693 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.702 2.6994186504652937 2.6994186504652937 2.6994186504652937 275630.8125 1 1 1 1 1 1 1 1 1 1 1 1 502.29041347000003 502.29041347000003 1.1752999995451319E-4 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 502.29041347000003 3.470000024208275E-6 502.29041347000003 502.29041347000003 502.29041347000003 1000000.0 1000000.0 0.23398814073032834 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00690835407396348 1000000.0 1000000.0 1000000.0 0.0 0.0 28.184368386549746 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 56.03254152395575 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.75 0.96 81.96550929908591 45.173227905761934 5.3318 5.0393 0 0 30 0 0 0 0 0 30 0 0 0 -0 PE(18:1e)+H PE(18:1e)+H PE (18:1e) (18:1e) 480.30846847000004 C23 H47 O7 N1 P1 1.6277203281E7 1741469.392 2.6994186504652937 8.221043294041133 2.2913664624987384 0.88 421.1898112352689 0.0 0.0 1.4488731654E7 0.0 0.0 0.0 0.0 0.0 1.6277203281E7 0.0 0.0 0.0 0.0 0.0 1741469.392 0.0 0.0 0.0 0.0 0.0 1685937.154 0.0 0.0 0.0 2.691 2.696 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.071 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.08 0.0 0.0 0.0 1.0 0.9 -4964 -4963 -4962 -4961 -4960 -4959 -4958 -4957 486 -4956 -4955 -4954 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 480.30847 480.309052 2.6994186504652937 2.6994186504652937 2.691 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.6994186504652937 2.696 2.6994186504652937 2.6994186504652937 2.6994186504652937 1714104.125 1 1 1 1 1 1 1 1 1 1 1 1 480.30846847000004 480.30846847000004 1.5299999631679384E-6 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 480.30846847000004 5.835299999716881E-4 480.30846847000004 480.30846847000004 480.30846847000004 1000000.0 1000000.0 0.003185452815441046 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2149067490533643 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.303989366927357 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 49.538410417919984 0.0 0.0 0.0 0.77 0.88 92.78327902619105 421.1898112352689 8.6564 335.8743 0 0 33 0 0 0 0 0 32 0 0 0 -0 PE(18:3e)+Na PE(18:3e)+Na PE (18:3e) (18:3e) 498.25911347000005 C23 H42 O7 N1 P1 Na1 4.8850668155E7 7248570.053 1.3772668896340818 1.8034791958131549 0.718066097076122 0.6 74.49820299861187 0.0 0.0 4.8850668155E7 0.0 0.0 0.0 0.0 0.0 4.7620418339E7 0.0 0.0 0.0 0.0 0.0 7248570.053 0.0 0.0 0.0 0.0 0.0 7175332.772 0.0 0.0 0.0 1.354 1.368 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -4995 -4994 253 -4993 -4992 -4991 -4990 -4989 266 -4988 -4987 -4986 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 498.259491 498.260026 1.3772668896340818 1.3772668896340818 1.354 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.368 1.3772668896340818 1.3772668896340818 1.3772668896340818 1227822.625 1569432.625 1 1 1 1 1 1 1 1 1 1 1 1 498.25911347000005 498.25911347000005 3.775299999801973E-4 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 498.25911347000005 9.125299999368508E-4 498.25911347000005 498.25911347000005 498.25911347000005 1000000.0 1000000.0 0.757698132907163 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.831436646651108 1000000.0 1000000.0 1000000.0 0.0 0.0 34.08277977795005 0.0 0.0 0.0 0.0 0.0 32.474352165595946 0.0 0.0 0.0 C C 0.0 0.0 67.6245630514882 0.0 0.0 0.0 0.0 0.0 64.17856159208684 0.0 0.0 0.0 0.6 0.81 74.49820299861187 106.92768509748181 40.6516 24.2673 0 0 27 0 0 0 0 0 27 0 0 0 -0 PE(18:3e)+H PE(18:3e)+H PE (18:3e) (18:3e) 476.27716847000005 C23 H43 O7 N1 P1 3.58054989595E8 4.934630906E7 1.3772668896340818 1.4715315766818589 0.3069591773002638 0.96 452.11237795146576 0.0 0.0 3.58054989595E8 0.0 0.0 0.0 0.0 0.0 3.50680385702E8 0.0 0.0 0.0 0.0 0.0 4.9132557808E7 0.0 0.0 0.0 0.0 0.0 4.934630906E7 0.0 0.0 0.0 1.376 1.373 0.0 0.0 0.058 0.0 0.0 0.0 0.0 0.0 0.053 0.0 0.0 0.0 0.0 0.0 0.056 0.0 0.0 0.0 0.0 0.0 0.058 0.0 0.0 0.0 0.93 0.93 -5005 -5004 210 -5003 -5002 -5001 -5000 -4999 220 -4998 -4997 -4996 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 476.27756 476.277833 1.3772668896340818 1.3772668896340818 1.376 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.3772668896340818 1.373 1.3772668896340818 1.3772668896340818 1.3772668896340818 551372.0 595576.25 1 1 1 1 1 1 1 1 1 1 1 1 476.27716847000005 476.27716847000005 3.915299999448507E-4 476.27716847000005 476.27716847000005 476.27716847000005 476.27716847000005 476.27716847000005 6.64529999937713E-4 476.27716847000005 476.27716847000005 476.27716847000005 1000000.0 1000000.0 0.8220633401399601 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.395258987686643 1000000.0 1000000.0 1000000.0 0.0 0.0 10.62745181858429 0.0 0.0 0.0 0.0 0.0 11.109661604473269 0.0 0.0 0.0 C C 0.0 0.0 49.66098980646864 0.0 0.0 0.0 0.0 0.0 52.40406417204372 0.0 0.0 0.0 0.96 0.92 452.11237795146576 1205.9245415877022 90.2098 75.7568 0 0 26 0 0 0 0 0 27 0 0 0 -0 PE(22:2)+H PE(22:2)+H PE (22:2) (22:2) 548.3346834700002 C27 H51 O8 N1 P1 2994225.918 399296.71 2.822 1.0230481745711668 1.9460867105291875 0.77 9.247641768805538 0.0 0.0 2994225.918 0.0 0.0 0.0 0.0 0.0 2951216.333 0.0 0.0 0.0 0.0 0.0 399296.71 0.0 0.0 0.0 0.0 0.0 388456.508 0.0 0.0 0.0 2.822 2.818 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5016 -5015 446 -5014 -5013 -5012 -5011 -5010 -5009 -5008 -5007 -5006 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 548.335083 548.33468 2.822 2.822 2.822 2.822 2.822 2.822 2.822 2.822 2.818 2.822 2.822 2.822 254396.046875 1 1 1 1 1 1 1 1 1 1 1 1 548.3346834700002 548.3346834700002 3.9952999986780924E-4 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 548.3346834700002 3.470000137895113E-6 548.3346834700002 548.3346834700002 548.3346834700002 1000000.0 1000000.0 0.7286243455173812 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006328252146911585 1000000.0 1000000.0 1000000.0 0.0 0.0 9.589158995049678 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 46.549315509949885 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.77 0.73 9.247641768805538 10.764203953881932 4.6973 3.6834 0 0 30 0 0 0 0 0 28 0 0 0 -0 PE(27:0)+Na PE(27:0)+Na PE (27:0) (27:0) 644.4261784700001 C32 H64 O8 N1 P1 Na1 3342022.144 933318.34 4.805126493812559 4.158069080812049 3.2495924867212036 0.96 1205.8318961079078 0.0 0.0 3342022.144 0.0 0.0 0.0 0.0 0.0 3151111.115 0.0 0.0 0.0 0.0 0.0 891390.029 0.0 0.0 0.0 0.0 0.0 933318.34 0.0 0.0 0.0 4.8 4.808 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.95 0.96 -5036 -5035 916 -5034 -5033 -5032 -5031 -5030 993 -5029 -5028 -5027 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 644.426605 644.425773 4.805126493812559 4.805126493812559 4.8 4.805126493812559 4.805126493812559 4.805126493812559 4.805126493812559 4.805126493812559 4.808 4.805126493812559 4.805126493812559 4.805126493812559 937271.125 853005.25 1 1 1 1 1 1 1 1 1 1 1 1 644.4261784700001 644.4261784700001 4.2652999991332763E-4 644.4261784700001 644.4261784700001 644.4261784700001 644.4261784700001 644.4261784700001 4.054700000324374E-4 644.4261784700001 644.4261784700001 644.4261784700001 1000000.0 1000000.0 0.6618756564576525 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6291954200170861 1000000.0 1000000.0 1000000.0 0.0 0.0 12.47264056600016 0.0 0.0 0.0 0.0 0.0 33.73978041222275 0.0 0.0 0.0 C C 0.0 0.0 41.300134324503844 0.0 0.0 0.0 0.0 0.0 55.86056359639529 0.0 0.0 0.0 0.96 0.98 1205.8318961079078 30.03113900642703 7.6453 8.3983 0 0 14 0 0 0 0 0 14 0 0 0 -0 PE(32:0)+H PE(32:0)+H PE (32:0) (32:0) 692.5224834700001 C37 H75 O8 N1 P1 6445385.977 2724388.679 6.265 2.300483082774419 2.690972604695905 1.0 82.43033873901182 0.0 0.0 6239049.884 0.0 0.0 0.0 0.0 0.0 6445385.977 0.0 0.0 0.0 0.0 0.0 2724388.679 0.0 0.0 0.0 0.0 0.0 2622645.055 0.0 0.0 0.0 6.266 6.263 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5047 -5046 1449 -5045 -5044 -5043 -5042 -5041 -5040 -5039 -5038 -5037 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 692.524873 692.52248 6.265 6.265 6.266 6.265 6.265 6.265 6.265 6.265 6.263 6.265 6.265 6.265 2445138.5 1 1 1 1 1 1 1 1 1 1 1 1 692.5224834700001 692.5224834700001 0.002389529999845763 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 3.470000137895113E-6 692.5224834700001 692.5224834700001 692.5224834700001 1000000.0 1000000.0 3.450472810460423 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0050106678421588495 1000000.0 1000000.0 1000000.0 0.0 0.0 5.233360150290266 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 45.507479567741434 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 86.99389739126742 82.43033873901182 8.2961 10.2239 0 0 9 0 0 0 0 0 9 0 0 0 -0 PE(32:0)+Na PE(32:0)+Na PE (32:0) (32:0) 714.5044284700001 C37 H74 O8 N1 P1 Na1 1.604491637843E9 5.92369376899E8 7.498 3.642911936155905 3.360601034574874 1.0 6.7078336E8 0.0 0.0 1.523906366052E9 0.0 0.0 0.0 0.0 0.0 1.604491637843E9 0.0 0.0 0.0 0.0 0.0 5.6486985723E8 0.0 0.0 0.0 0.0 0.0 5.92369376899E8 0.0 0.0 0.0 7.5 7.499 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.93 0.92 -5058 -5057 1956 -5056 -5055 -5054 -5053 -5052 -5051 -5050 -5049 -5048 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.506882 714.50443 7.498 7.498 7.5 7.498 7.498 7.498 7.498 7.498 7.499 7.498 7.498 7.498 1.6398713E7 1 1 1 1 1 1 1 1 1 1 1 1 714.5044284700001 714.5044284700001 0.0024535299999115523 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 714.5044284700001 1.5299998494811007E-6 714.5044284700001 714.5044284700001 714.5044284700001 1000000.0 1000000.0 3.4338905430794946 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021413441100111264 1000000.0 1000000.0 1000000.0 0.0 0.0 11.819303550087918 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 55.48968802858178 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 115.64878644372824 6.7078336E8 24.1072 27.0486 0 0 13 0 0 0 0 0 14 0 0 0 -0 PE(32:0)+H PE(32:0)+H PE (32:0) (32:0) 692.5224834700001 C37 H75 O8 N1 P1 1.4373677896E7 5211783.412 8.112 3.362971739655022 4.7039276689573795 0.99 24.18938831868967 0.0 0.0 1.3705949928E7 0.0 0.0 0.0 0.0 0.0 1.4373677896E7 0.0 0.0 0.0 0.0 0.0 4876237.755 0.0 0.0 0.0 0.0 0.0 5211783.412 0.0 0.0 0.0 8.113 8.117 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.94 0.92 -5069 -5068 2284 -5067 -5066 -5065 -5064 -5063 -5062 -5061 -5060 -5059 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 692.521917 692.52248 8.112 8.112 8.113 8.112 8.112 8.112 8.112 8.112 8.117 8.112 8.112 8.112 5419806.0 1 1 1 1 1 1 1 1 1 1 1 1 692.5224834700001 692.5224834700001 5.664700000806988E-4 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 692.5224834700001 3.470000137895113E-6 692.5224834700001 692.5224834700001 692.5224834700001 1000000.0 1000000.0 0.8179806628693206 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0050106678421588495 1000000.0 1000000.0 1000000.0 0.0 0.0 5.273588698538926 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 49.75083677866911 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 58.23859352244079 24.18938831868967 12.7793 12.1793 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(32:0e)+Na PE(32:0e)+Na PE (32:0e) (32:0e) 700.52516347 C37 H76 O7 N1 P1 Na1 9.0573634819E7 3.758310071E7 7.789 5.6664331980142615 6.880241761084767 1.0 190.63241225186397 0.0 0.0 8.3595088834E7 0.0 0.0 0.0 0.0 0.0 9.0573634819E7 0.0 0.0 0.0 0.0 0.0 3.4095871678E7 0.0 0.0 0.0 0.0 0.0 3.758310071E7 0.0 0.0 0.0 7.788 7.79 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.94 0.94 -5080 -5079 2130 -5078 -5077 -5076 -5075 -5074 -5073 -5072 -5071 -5070 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 700.527579 700.52516 7.789 7.789 7.788 7.789 7.789 7.789 7.789 7.789 7.79 7.789 7.789 7.789 2.5913202E7 1 1 1 1 1 1 1 1 1 1 1 1 700.52516347 700.52516347 0.0024155299998938062 700.52516347 700.52516347 700.52516347 700.52516347 700.52516347 3.470000024208275E-6 700.52516347 700.52516347 700.52516347 1000000.0 1000000.0 3.4481702098018228 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0049534266649607335 1000000.0 1000000.0 1000000.0 0.0 0.0 11.271948916479769 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 53.932769935309906 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 193.99273968844977 190.63241225186397 15.7606 15.2954 0 0 10 0 0 0 0 0 11 0 0 0 -0 PE(16:0_16:1)+H PE(32:1)+H PE (16:0_16:1) (16:0) (16:1) 690.5068334700001 C37 H73 O8 N1 P1 2.00778883673E8 6.3075212432E7 7.759089930400177 0.14303902023042658 4.046768034803495 0.99 55.012951125186895 0.0 0.0 2.00373143024E8 0.0 0.0 0.0 0.0 0.0 2.00778883673E8 0.0 0.0 0.0 0.0 0.0 6.3075212432E7 0.0 0.0 0.0 0.0 0.0 5.9565842187E7 0.0 0.0 0.0 7.76 7.762 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.9 0.94 -5090 -5089 2107 -5088 -5087 -5086 -5085 -5084 2201 -5083 -5082 -5081 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 690.507141 690.507133 7.759089930400177 7.759089930400177 7.76 7.759089930400177 7.759089930400177 7.759089930400177 7.759089930400177 7.759089930400177 7.762 7.759089930400177 7.759089930400177 7.759089930400177 1.77899E7 2.0234506E7 1 1 1 1 1 1 1 1 1 1 1 1 690.5068334700001 690.5068334700001 3.0752999998640007E-4 690.5068334700001 690.5068334700001 690.5068334700001 690.5068334700001 690.5068334700001 2.995299998929113E-4 690.5068334700001 690.5068334700001 690.5068334700001 1000000.0 1000000.0 0.44536851060687016 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4337828177422733 1000000.0 1000000.0 1000000.0 0.0 0.0 16.015420067916526 0.0 0.0 0.0 0.0 0.0 16.3129952229641 0.0 0.0 0.0 B B 0.0 0.0 51.0045225092883 0.0 0.0 0.0 0.0 0.0 52.11819560052429 0.0 0.0 0.0 0.99 0.99 122.03311502106406 55.012951125186895 41.5043 57.2276 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(32:1)+Na PE(32:1)+Na PE (16:0_16:1) (16:0) (16:1) 712.48877847 C37 H72 O8 N1 P1 Na1 3.0676220907E7 9950796.952 7.759089930400177 9.674599826169832 16.19001906603424 0.99 9964774.0 0.0 0.0 3.0676220907E7 0.0 0.0 0.0 0.0 0.0 2.6747854203E7 0.0 0.0 0.0 0.0 0.0 9950796.952 0.0 0.0 0.0 0.0 0.0 7906482.675 0.0 0.0 0.0 7.757 7.756 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 1.0 0.95 -5100 -5099 2128 -5098 -5097 -5096 -5095 -5094 2210 -5093 -5092 -5091 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 712.488213 712.488536 7.759089930400177 7.759089930400177 7.757 7.759089930400177 7.759089930400177 7.759089930400177 7.759089930400177 7.759089930400177 7.756 7.759089930400177 7.759089930400177 7.759089930400177 6405856.5 8158723.0 1 1 1 1 1 1 1 1 1 1 1 1 712.48877847 712.48877847 5.654700000832236E-4 712.48877847 712.48877847 712.48877847 712.48877847 712.48877847 2.424700001029123E-4 712.48877847 712.48877847 712.48877847 1000000.0 1000000.0 0.7936546050556965 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.34031413185705595 1000000.0 1000000.0 1000000.0 0.0 0.0 24.636058656041097 0.0 0.0 0.0 0.0 0.0 38.64104133307341 0.0 0.0 0.0 C C 0.0 0.0 60.679947428672655 0.0 0.0 0.0 0.0 0.0 63.65904667722143 0.0 0.0 0.0 0.99 0.94 9964774.0 49.680791158918 6.2323 6.9912 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(16:1_16:1)+H PE(32:2)+H PE (16:1_16:1) (16:1) (16:1) 688.4911834700001 C37 H71 O8 N1 P1 2.78822654038E8 9.7529212323E7 7.342280809109864 7.52283448585904 7.094113329443657 0.98 1006.6939373073509 0.0 0.0 2.50657249707E8 0.0 0.0 0.0 0.0 0.0 2.78822654038E8 0.0 0.0 0.0 0.0 0.0 8.8211889526E7 0.0 0.0 0.0 0.0 0.0 9.7529212323E7 0.0 0.0 0.0 7.342 7.341 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.92 0.92 -5110 -5109 1906 -5108 -5107 -5106 -5105 -5104 2003 -5103 -5102 -5101 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 688.491586 688.490761 7.342280809109864 7.342280809109864 7.342 7.342280809109864 7.342280809109864 7.342280809109864 7.342280809109864 7.342280809109864 7.341 7.342280809109864 7.342280809109864 7.342280809109864 1.3528588E7 1.5177022E7 1 1 1 1 1 1 1 1 1 1 1 1 688.4911834700001 688.4911834700001 4.0252999986023497E-4 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 688.4911834700001 4.2247000010320335E-4 688.4911834700001 688.4911834700001 688.4911834700001 1000000.0 1000000.0 0.5846552715918324 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6136171533438551 1000000.0 1000000.0 1000000.0 0.0 0.0 24.54229553986707 0.0 0.0 0.0 0.0 0.0 12.329121521937909 0.0 0.0 0.0 A C 0.0 0.0 58.99590274006506 0.0 0.0 0.0 0.0 0.0 57.612717392233215 0.0 0.0 0.0 0.96 0.98 165.99821561289062 1006.6939373073509 7.3768 10.0907 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(32:2)+Na PE(32:2)+Na PE (16:1_16:1) (16:1) (16:1) 710.4731284700001 C37 H70 O8 N1 P1 Na1 2.8423082662E7 9439695.007 7.342280809109864 15.592713247797999 21.012376488423026 0.98 34.02298575398707 0.0 0.0 2.2777818145E7 0.0 0.0 0.0 0.0 0.0 2.8423082662E7 0.0 0.0 0.0 0.0 0.0 6997463.063 0.0 0.0 0.0 0.0 0.0 9439695.007 0.0 0.0 0.0 7.348 7.347 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.93 1.0 -5120 -5119 1913 -5118 -5117 -5116 -5115 -5114 2014 -5113 -5112 -5111 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 710.472839 710.472669 7.342280809109864 7.342280809109864 7.348 7.342280809109864 7.342280809109864 7.342280809109864 7.342280809109864 7.342280809109864 7.347 7.342280809109864 7.342280809109864 7.342280809109864 4191854.75 7837174.5 1 1 1 1 1 1 1 1 1 1 1 1 710.4731284700001 710.4731284700001 2.8947000009793555E-4 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 710.4731284700001 4.5947000012347416E-4 710.4731284700001 710.4731284700001 710.4731284700001 1000000.0 1000000.0 0.40743272123649144 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6467098919179959 1000000.0 1000000.0 1000000.0 0.0 0.0 32.93370496527917 0.0 0.0 0.0 0.0 0.0 43.03374878349745 0.0 0.0 0.0 C C 0.0 0.0 64.57589208878268 0.0 0.0 0.0 0.0 0.0 70.66297008784474 0.0 0.0 0.0 0.98 0.98 3.6067715678164642 34.02298575398707 5.1364 5.813 0 0 13 0 0 0 0 0 12 0 0 0 -0 PE(32:3)+Na PE(32:3)+Na PE (32:3) (32:3) 708.4574784700002 C37 H68 O8 N1 P1 Na1 3889584.146 1004531.505 7.006906270617918 23.461755939343877 12.742941256089061 0.95 44.350794660537844 0.0 0.0 3889584.146 0.0 0.0 0.0 0.0 0.0 2782660.9112999854 0.0 0.0 0.0 0.0 0.0 1004531.505 0.0 0.0 0.0 0.0 0.0 838466.0 0.0 0.0 0.0 7.004 7.016 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.87 -5130 -5129 1798 -5128 -5127 -5126 -5125 -5124 1894 -5123 -5122 -5121 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 708.457395 708.457766 7.006906270617918 7.006906270617918 7.004 7.006906270617918 7.006906270617918 7.006906270617918 7.006906270617918 7.006906270617918 7.016 7.006906270617918 7.006906270617918 7.006906270617918 6134833.5 4831377.0 1 1 1 1 1 1 1 1 1 1 1 1 708.4574784700002 708.4574784700002 8.34700001632882E-5 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 708.4574784700002 2.8752999980952154E-4 708.4574784700002 708.4574784700002 708.4574784700002 1000000.0 1000000.0 0.1178193507725429 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4058535742052966 1000000.0 1000000.0 1000000.0 0.0 0.0 43.513560784812334 0.0 0.0 0.0 0.0 0.0 28.93296631671464 0.0 0.0 0.0 C C 0.0 0.0 71.45083872711385 0.0 0.0 0.0 0.0 0.0 71.0883693285372 0.0 0.0 0.0 0.95 0.39819215881653136 44.350794660537844 0.0 13.0979 10.8283 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(32:3)+H PE(32:3)+H PE (32:3) (32:3) 686.4755334700002 C37 H69 O8 N1 P1 2.7562884615E7 7420070.771 7.006906270617918 21.408449603872672 0.281885746880791 0.97 99.81252209573641 0.0 0.0 2.7562884615E7 0.0 0.0 0.0 0.0 0.0 2.031508838789985E7 0.0 0.0 0.0 0.0 0.0 7420070.771 0.0 0.0 0.0 0.0 0.0 7390549.75 0.0 0.0 0.0 7.008 7.007 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 1.0 -5140 -5139 1814 -5138 -5137 -5136 -5135 -5134 1883 -5133 -5132 -5131 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 686.475014 686.475475 7.006906270617918 7.006906270617918 7.008 7.006906270617918 7.006906270617918 7.006906270617918 7.006906270617918 7.006906270617918 7.007 7.006906270617918 7.006906270617918 7.006906270617918 3.1950642E7 4318589.0 1 1 1 1 1 1 1 1 1 1 1 1 686.4755334700002 686.4755334700002 5.194700001993624E-4 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 686.4755334700002 5.847000022640714E-5 686.4755334700002 686.4755334700002 686.4755334700002 1000000.0 1000000.0 0.7567203416173373 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.08517419394519811 1000000.0 1000000.0 1000000.0 0.0 0.0 8.974329171875107 0.0 0.0 0.0 0.0 0.0 10.291409005448408 0.0 0.0 0.0 C C 0.0 0.0 43.7772154725615 0.0 0.0 0.0 0.0 0.0 48.31647420398315 0.0 0.0 0.0 0.97 0.945876787097953 99.81252209573641 0.0 24.7732 25.4496 0 0 11 0 0 0 0 0 12 0 0 0 -0 PE(32:4)+H PE(32:4)+H PE (32:4) (32:4) 684.4598834700001 C37 H67 O8 N1 P1 1.7757610143E7 3922257.925 6.578717379143307 1.8681163767572568 2.9168030525552346 0.95 6.586569290401244 0.0 0.0 1.7294585446E7 0.0 0.0 0.0 0.0 0.0 1.7757610143E7 0.0 0.0 0.0 0.0 0.0 3763734.996 0.0 0.0 0.0 0.0 0.0 3922257.925 0.0 0.0 0.0 6.57 6.568 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5150 -5149 1568 -5148 -5147 -5146 -5145 -5144 1669 -5143 -5142 -5141 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 684.460718 684.460143 6.578717379143307 6.578717379143307 6.57 6.578717379143307 6.578717379143307 6.578717379143307 6.578717379143307 6.578717379143307 6.568 6.578717379143307 6.578717379143307 6.578717379143307 1820323.75 2171689.25 1 1 1 1 1 1 1 1 1 1 1 1 684.4598834700001 684.4598834700001 8.345299999064082E-4 684.4598834700001 684.4598834700001 684.4598834700001 684.4598834700001 684.4598834700001 2.5952999988021475E-4 684.4598834700001 684.4598834700001 684.4598834700001 1000000.0 1000000.0 1.2192533412997104 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.37917488832870355 1000000.0 1000000.0 1000000.0 0.0 0.0 6.2559139920091935 0.0 0.0 0.0 0.0 0.0 6.321564601027893 0.0 0.0 0.0 C C 0.0 0.0 54.87643852639644 0.0 0.0 0.0 0.0 0.0 56.95103244169274 0.0 0.0 0.0 0.76 0.95 64.48394950739605 6.586569290401244 9.8649 9.8821 0 0 16 0 0 0 0 0 10 0 0 0 -0 PE(32:5)+H PE(32:5)+H PE (32:5) (32:5) 682.4442334700001 C37 H65 O8 N1 P1 2571757.9 862820.495 6.104 0.8153811585572349 4.376211729622941 0.98 19.047553736202044 0.0 0.0 2542272.368 0.0 0.0 0.0 0.0 0.0 2571757.9 0.0 0.0 0.0 0.0 0.0 862820.495 0.0 0.0 0.0 0.0 0.0 811024.224 0.0 0.0 0.0 6.106 6.11 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.95 0.96 -5161 -5160 1383 -5159 -5158 -5157 -5156 -5155 -5154 -5153 -5152 -5151 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 682.444291 682.44423 6.104 6.104 6.106 6.104 6.104 6.104 6.104 6.104 6.11 6.104 6.104 6.104 939593.6875 1 1 1 1 1 1 1 1 1 1 1 1 682.4442334700001 682.4442334700001 5.752999993546837E-5 682.4442334700001 682.4442334700001 682.4442334700001 682.4442334700001 682.4442334700001 3.470000137895113E-6 682.4442334700001 682.4442334700001 682.4442334700001 1000000.0 1000000.0 0.08429992827831163 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005084664750189661 1000000.0 1000000.0 1000000.0 0.0 0.0 9.08516348469972 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 43.88967867004695 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 19.967010355987902 19.047553736202044 5.0626 4.5229 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(32:6)+H PE(32:6)+H PE (32:6) (32:6) 680.4285834700001 C37 H63 O8 N1 P1 1718720.7 514834.811 5.57497710689288 1.5454099558272971 1.128301158114762 0.99 571569.06 0.0 0.0 1718720.7 0.0 0.0 0.0 0.0 0.0 1681563.42 0.0 0.0 0.0 0.0 0.0 514834.811 0.0 0.0 0.0 0.0 0.0 506684.827 0.0 0.0 0.0 5.572 5.578 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.99 0.95 -5171 -5170 1175 -5169 -5168 -5167 -5166 -5165 1269 -5164 -5163 -5162 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 680.428797 680.428175 5.57497710689288 5.57497710689288 5.572 5.57497710689288 5.57497710689288 5.57497710689288 5.57497710689288 5.57497710689288 5.578 5.57497710689288 5.57497710689288 5.57497710689288 512860.8125 519589.0 1 1 1 1 1 1 1 1 1 1 1 1 680.4285834700001 680.4285834700001 2.1352999988266674E-4 680.4285834700001 680.4285834700001 680.4285834700001 680.4285834700001 680.4285834700001 4.0847000013854995E-4 680.4285834700001 680.4285834700001 680.4285834700001 1000000.0 1000000.0 0.31381691638191034 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6003128176295364 1000000.0 1000000.0 1000000.0 0.0 0.0 12.264069575330709 0.0 0.0 0.0 0.0 0.0 11.144400656036808 0.0 0.0 0.0 C C 0.0 0.0 60.11798811436623 0.0 0.0 0.0 0.0 0.0 53.322491177209606 0.0 0.0 0.0 0.99 0.98 571569.06 555841.75 6.9855 3.6775 0 0 11 0 0 0 0 0 10 0 0 0 -0 PE(33:1)+Na PE(33:1)+Na PE (33:1) (33:1) 726.5044284700001 C38 H74 O8 N1 P1 Na1 1.02803489442E8 2.6922629444E7 7.4 5.688897131874331 0.028011576579380526 0.98 99.36318658049035 0.0 0.0 9.485246682E7 0.0 0.0 0.0 0.0 0.0 1.02803489442E8 0.0 0.0 0.0 0.0 0.0 2.6911966331E7 0.0 0.0 0.0 0.0 0.0 2.6922629444E7 0.0 0.0 0.0 7.401 7.397 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.91 0.94 -5182 -5181 1947 -5180 -5179 -5178 -5177 -5176 -5175 -5174 -5173 -5172 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 726.506385 726.50443 7.4 7.4 7.401 7.4 7.4 7.4 7.4 7.4 7.397 7.4 7.4 7.4 3.1929086E7 1 1 1 1 1 1 1 1 1 1 1 1 726.5044284700001 726.5044284700001 0.0019565299999158015 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 726.5044284700001 1.5299998494811007E-6 726.5044284700001 726.5044284700001 726.5044284700001 1000000.0 1000000.0 2.6930737422154523 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0021059745674272645 1000000.0 1000000.0 1000000.0 0.0 0.0 10.811035375116393 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 51.481120833887594 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.98 44.81931929428491 99.36318658049035 11.624 13.2971 0 0 13 0 0 0 0 0 13 0 0 0 -0 PE(33:2)+Na PE(33:2)+Na PE (33:2) (33:2) 724.48877847 C38 H72 O8 N1 P1 Na1 4.3664205557E7 1.1573303246E7 6.927 0.14196120284403724 11.491233688559715 0.99 23.688759665350318 0.0 0.0 4.3664205557E7 0.0 0.0 0.0 0.0 0.0 4.3576631696E7 0.0 0.0 0.0 0.0 0.0 1.1573303246E7 0.0 0.0 0.0 0.0 0.0 9833858.087 0.0 0.0 0.0 6.926 6.921 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5193 -5192 1705 -5191 -5190 -5189 -5188 -5187 -5186 -5185 -5184 -5183 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 724.491638 724.48878 6.927 6.927 6.926 6.927 6.927 6.927 6.927 6.927 6.921 6.927 6.927 6.927 1543493.875 1 1 1 1 1 1 1 1 1 1 1 1 724.48877847 724.48877847 0.0028595299999096824 724.48877847 724.48877847 724.48877847 724.48877847 724.48877847 1.5299999631679384E-6 724.48877847 724.48877847 724.48877847 1000000.0 1000000.0 3.9469624442610898 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002111833900863232 1000000.0 1000000.0 1000000.0 0.0 0.0 7.745398213146524 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 37.237491409358284 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 23.688759665350318 13.867945203356376 6.1999 4.8985 0 0 23 0 0 0 0 0 22 0 0 0 -0 PE(33:2)+H PE(33:2)+H PE (33:2) (33:2) 702.5068334700001 C38 H73 O8 N1 P1 2.1713502887E7 4699467.134 7.568 0.6225770572969792 2.0757467220482315 0.98 15.549720425892025 0.0 0.0 2.152316278E7 0.0 0.0 0.0 0.0 0.0 2.1713502887E7 0.0 0.0 0.0 0.0 0.0 4699467.134 0.0 0.0 0.0 0.0 0.0 4563507.546 0.0 0.0 0.0 7.62 7.621 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5204 -5203 2040 -5202 -5201 -5200 -5199 -5198 -5197 -5196 -5195 -5194 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 702.508903 702.50683 7.568 7.568 7.62 7.568 7.568 7.568 7.568 7.568 7.621 7.568 7.568 7.568 1712998.375 1 1 1 1 1 1 1 1 1 1 1 1 702.5068334700001 702.5068334700001 0.0020695299999715644 702.5068334700001 702.5068334700001 702.5068334700001 702.5068334700001 702.5068334700001 3.470000024208275E-6 702.5068334700001 702.5068334700001 702.5068334700001 1000000.0 1000000.0 2.9459215218579677 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004939453765977436 1000000.0 1000000.0 1000000.0 0.0 0.0 8.077777812477427 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 38.10272553055389 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.98 14.59228862064822 15.549720425892025 5.2519 5.4173 0 0 22 0 0 0 0 0 23 0 0 0 -0 PE(15:0_18:3)+H PE(33:3)+H PE (15:0_18:3) (15:0) (18:3) 700.4911834700001 C38 H71 O8 N1 P1 4.1743467959E7 1.3943876587E7 7.267 7.8066543513452356 3.1623572412058474 0.99 72.08100011764334 0.0 0.0 3.7375965846E7 0.0 0.0 0.0 0.0 0.0 4.1743467959E7 0.0 0.0 0.0 0.0 0.0 1.3333911356E7 0.0 0.0 0.0 0.0 0.0 1.3943876587E7 0.0 0.0 0.0 7.266 7.267 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.94 0.94 -5215 -5214 1876 -5213 -5212 -5211 -5210 -5209 -5208 -5207 -5206 -5205 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 700.491218 700.49118 7.267 7.267 7.266 7.267 7.267 7.267 7.267 7.267 7.267 7.267 7.267 7.267 3008555.0 1 1 1 1 1 1 1 1 1 1 1 1 700.4911834700001 700.4911834700001 3.452999987985095E-5 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 700.4911834700001 3.470000137895113E-6 700.4911834700001 700.4911834700001 700.4911834700001 1000000.0 1000000.0 0.04929398212951207 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004953667112133928 1000000.0 1000000.0 1000000.0 0.0 0.0 12.973005200091647 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 41.58014487208861 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 1.5176032E7 72.08100011764334 17.2371 9.3043 0 0 14 0 0 0 0 0 14 0 0 0 -0 PE(33:4)+H PE(33:4)+H PE (33:4) (33:4) 698.4755334700001 C38 H69 O8 N1 P1 9319150.772 2315416.35 6.859086042499965 2.8468869136616046 8.118056538670974 0.86 1.1760579693634194 0.0 0.0 9319150.772 0.0 0.0 0.0 0.0 0.0 8951355.784 0.0 0.0 0.0 0.0 0.0 2315416.35 0.0 0.0 0.0 0.0 0.0 2064022.012 0.0 0.0 0.0 6.862 6.867 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5225 -5224 1701 -5223 -5222 -5221 -5220 -5219 1797 -5218 -5217 -5216 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 698.475372 698.474515 6.859086042499965 6.859086042499965 6.862 6.859086042499965 6.859086042499965 6.859086042499965 6.859086042499965 6.859086042499965 6.867 6.859086042499965 6.859086042499965 6.859086042499965 2220231.75 1982932.0 1 1 1 1 1 1 1 1 1 1 1 1 698.4755334700001 698.4755334700001 1.6147000008004397E-4 698.4755334700001 698.4755334700001 698.4755334700001 698.4755334700001 698.4755334700001 0.0010184700000763769 698.4755334700001 698.4755334700001 698.4755334700001 1000000.0 1000000.0 0.23117488350360266 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.4581326779145096 1000000.0 1000000.0 1000000.0 0.0 0.0 10.32467779288405 0.0 0.0 0.0 0.0 0.0 10.697098362882999 0.0 0.0 0.0 C C 0.0 0.0 48.70131034379268 0.0 0.0 0.0 0.0 0.0 50.69714863925591 0.0 0.0 0.0 0.86 0.89 1.1760579693634194 6.617870836121142 2.7844 3.3042 0 0 12 0 0 0 0 0 13 0 0 0 -0 PE(34:0)+Na PE(34:0)+Na PE (34:0) (34:0) 742.5357284700001 C39 H78 O8 N1 P1 Na1 9.52293497209E8 3.05577071231E8 7.86 7.708206945019988 0.45369374863097967 0.99 98.56970264902942 0.0 0.0 8.53849229121E8 0.0 0.0 0.0 0.0 0.0 9.52293497209E8 0.0 0.0 0.0 0.0 0.0 3.03622697901E8 0.0 0.0 0.0 0.0 0.0 3.05577071231E8 0.0 0.0 0.0 7.861 7.863 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.96 0.95 -5236 -5235 2148 -5234 -5233 -5232 -5231 -5230 -5229 -5228 -5227 -5226 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 742.536631 742.53573 7.86 7.86 7.861 7.86 7.86 7.86 7.86 7.86 7.863 7.86 7.86 7.86 2.0576004E7 1 1 1 1 1 1 1 1 1 1 1 1 742.5357284700001 742.5357284700001 9.025299999620984E-4 742.5357284700001 742.5357284700001 742.5357284700001 742.5357284700001 742.5357284700001 1.5299998494811007E-6 742.5357284700001 742.5357284700001 742.5357284700001 1000000.0 1000000.0 1.2154701320861254 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020605067080525213 1000000.0 1000000.0 1000000.0 0.0 0.0 11.707142715628349 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 54.19973479457568 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 77.76866363256005 98.56970264902942 11.9142 12.4522 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(34:0e)+Na PE(34:0e)+Na PE (34:0e) (34:0e) 728.5564634700002 C39 H80 O7 N1 P1 Na1 3.5977639842E7 9701017.683 8.182 1.7806333534229206 13.62192639047748 0.92 7988055.0 0.0 0.0 3.5977639842E7 0.0 0.0 0.0 0.0 0.0 3.5082917839E7 0.0 0.0 0.0 0.0 0.0 7996376.933 0.0 0.0 0.0 0.0 0.0 9701017.683 0.0 0.0 0.0 8.18 8.183 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5247 -5246 2316 -5245 -5244 -5243 -5242 -5241 -5240 -5239 -5238 -5237 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 728.55805 728.55646 8.182 8.182 8.18 8.182 8.182 8.182 8.182 8.182 8.183 8.182 8.182 8.182 7988055.0 1 1 1 1 1 1 1 1 1 1 1 1 728.5564634700002 728.5564634700002 0.0015865299998267801 728.5564634700002 728.5564634700002 728.5564634700002 728.5564634700002 728.5564634700002 3.470000137895113E-6 728.5564634700002 728.5564634700002 728.5564634700002 1000000.0 1000000.0 2.17763492519219 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004762843117701608 1000000.0 1000000.0 1000000.0 0.0 0.0 5.223679500669289 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 25.606272062104356 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.95 7988055.0 9614382.0 5.9988 5.6206 0 0 17 0 0 0 0 0 14 0 0 0 -0 PE(34:1)+Na PE(34:1)+Na PE (34:1) (34:1) 740.52007847 C39 H76 O8 N1 P1 Na1 2.064299581449E9 5.50786517502E8 7.533 1.877565866757153 2.777970453318451 0.99 373.74947343234606 0.0 0.0 2.0102048489E9 0.0 0.0 0.0 0.0 0.0 2.064299581449E9 0.0 0.0 0.0 0.0 0.0 5.50786517502E8 0.0 0.0 0.0 0.0 0.0 5.29564938916E8 0.0 0.0 0.0 7.534 7.532 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 1.0 0.91 -5258 -5257 2044 -5256 -5255 -5254 -5253 -5252 -5251 -5250 -5249 -5248 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.52245 740.52008 7.533 7.533 7.534 7.533 7.533 7.533 7.533 7.533 7.532 7.533 7.533 7.533 5.0239132E7 1 1 1 1 1 1 1 1 1 1 1 1 740.52007847 740.52007847 0.0023715300000048956 740.52007847 740.52007847 740.52007847 740.52007847 740.52007847 1.5299999631679384E-6 740.52007847 740.52007847 740.52007847 1000000.0 1000000.0 3.2025195115637515 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020661154338030845 1000000.0 1000000.0 1000000.0 0.0 0.0 6.682803195043242 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 60.75275631857493 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 102.0044633453418 373.74947343234606 42.8642 36.5438 0 0 12 0 0 0 0 0 12 0 0 0 -0 PE(34:1)+Na PE(34:1)+Na PE (34:1) (34:1) 740.52007847 C39 H76 O8 N1 P1 Na1 4.9432743905E7 1.6836022662E7 8.14693660332562 3.1471614122920935 5.745194055165466 0.98 2.0636762E7 0.0 0.0 4.7280507351E7 0.0 0.0 0.0 0.0 0.0 4.9432743905E7 0.0 0.0 0.0 0.0 0.0 1.5521509043E7 0.0 0.0 0.0 0.0 0.0 1.6836022662E7 0.0 0.0 0.0 8.147 8.148 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.95 0.95 -5268 -5267 2292 -5266 -5265 -5264 -5263 -5262 2389 -5261 -5260 -5259 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.520019 740.519941 8.14693660332562 8.14693660332562 8.147 8.14693660332562 8.14693660332562 8.14693660332562 8.14693660332562 8.14693660332562 8.148 8.14693660332562 8.14693660332562 8.14693660332562 9535500.0 1.852727E7 1 1 1 1 1 1 1 1 1 1 1 1 740.52007847 740.52007847 5.9469999996508704E-5 740.52007847 740.52007847 740.52007847 740.52007847 740.52007847 1.374700000269513E-4 740.52007847 740.52007847 740.52007847 1000000.0 1000000.0 0.08030842339802667 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.18563980103143213 1000000.0 1000000.0 1000000.0 0.0 0.0 42.62525277483156 0.0 0.0 0.0 0.0 0.0 39.048835088143186 0.0 0.0 0.0 C C 0.0 0.0 69.99220488478089 0.0 0.0 0.0 0.0 0.0 64.33086505460162 0.0 0.0 0.0 0.99 0.98 1.8347602E7 2.0636762E7 8.8784 11.4957 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(34:1)+H PE(34:1)+H PE (34:1) (34:1) 718.53813347 C39 H77 O8 N1 P1 2.92483118058E8 1.03146038304E8 8.14693660332562 3.426476002492942 3.5902354811685995 1.0 14.458369636594966 0.0 0.0 2.7864533575E8 0.0 0.0 0.0 0.0 0.0 2.92483118058E8 0.0 0.0 0.0 0.0 0.0 9.8038604311E7 0.0 0.0 0.0 0.0 0.0 1.03146038304E8 0.0 0.0 0.0 8.147 8.15 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.93 0.95 -5278 -5277 2285 -5276 -5275 -5274 -5273 -5272 2381 -5271 -5270 -5269 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 718.537865 718.537971 8.14693660332562 8.14693660332562 8.147 8.14693660332562 8.14693660332562 8.14693660332562 8.14693660332562 8.14693660332562 8.15 8.14693660332562 8.14693660332562 8.14693660332562 8248204.0 2.6265994E7 1 1 1 1 1 1 1 1 1 1 1 1 718.53813347 718.53813347 2.684700000372686E-4 718.53813347 718.53813347 718.53813347 718.53813347 718.53813347 1.6247000007751922E-4 718.53813347 718.53813347 718.53813347 1000000.0 1000000.0 0.3736336146013016 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2261118686810831 1000000.0 1000000.0 1000000.0 0.0 0.0 7.750244339845522 0.0 0.0 0.0 0.0 0.0 10.670084685723435 0.0 0.0 0.0 C C 0.0 0.0 36.386123661246586 0.0 0.0 0.0 0.0 0.0 50.09429429917106 0.0 0.0 0.0 0.99 1.0 18.488358298263424 14.458369636594966 56.4423 68.6763 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(16:0p_18:1)+H PE(34:1p)+H PE (16:0p_18:1) (16:0p) (18:1) 702.54321847 C39 H77 O7 N1 P1 2.6890123522E7 1.0791135695E7 8.345 4.079876404279894 3.1760526191636878 1.0 11.298853752896475 0.0 0.0 2.5382117322E7 0.0 0.0 0.0 0.0 0.0 2.6890123522E7 0.0 0.0 0.0 0.0 0.0 1.0317085502E7 0.0 0.0 0.0 0.0 0.0 1.0791135695E7 0.0 0.0 0.0 8.345 8.353 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5289 -5288 2392 -5287 -5286 -5285 -5284 -5283 -5282 -5281 -5280 -5279 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 702.542728 702.54322 8.345 8.345 8.345 8.345 8.345 8.345 8.345 8.345 8.353 8.345 8.345 8.345 8108730.5 1 1 1 1 1 1 1 1 1 1 1 1 702.54321847 702.54321847 4.904700000452067E-4 702.54321847 702.54321847 702.54321847 702.54321847 702.54321847 1.5299999631679384E-6 702.54321847 702.54321847 702.54321847 1000000.0 1000000.0 0.6981349860772312 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002177801910179953 1000000.0 1000000.0 1000000.0 0.0 0.0 10.311321664146925 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 49.336467292569026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 12.054538526023881 11.298853752896475 25.1774 14.2441 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(34:2)+Na PE(34:2)+Na PE (34:2) (34:2) 738.5044284700001 C39 H74 O8 N1 P1 Na1 8.3855181922E7 2.5412236324E7 7.827465705363534 7.2656411557164375 9.962389635349183 0.95 104.3427459481399 0.0 0.0 7.5659957436E7 0.0 0.0 0.0 0.0 0.0 8.3855181922E7 0.0 0.0 0.0 0.0 0.0 2.2067536425E7 0.0 0.0 0.0 0.0 0.0 2.5412236324E7 0.0 0.0 0.0 7.823 7.824 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5299 -5298 2142 -5297 -5296 -5295 -5294 -5293 2238 -5292 -5291 -5290 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.504002 738.503078 7.827465705363534 7.827465705363534 7.823 7.827465705363534 7.827465705363534 7.827465705363534 7.827465705363534 7.827465705363534 7.824 7.827465705363534 7.827465705363534 7.827465705363534 1.0793873E7 1.8544786E7 1 1 1 1 1 1 1 1 1 1 1 1 738.5044284700001 738.5044284700001 4.264700000931043E-4 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 738.5044284700001 0.0013504700001476522 738.5044284700001 738.5044284700001 738.5044284700001 1000000.0 1000000.0 0.5774779184149856 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.828655249834445 1000000.0 1000000.0 1000000.0 0.0 0.0 42.283290500975625 0.0 0.0 0.0 0.0 0.0 39.94702189599321 0.0 0.0 0.0 C C 0.0 0.0 69.4306904777925 0.0 0.0 0.0 0.0 0.0 65.70233864472567 0.0 0.0 0.0 0.92 0.95 0.894545265793678 104.3427459481399 6.8354 13.8968 0 0 13 0 0 0 0 0 15 0 0 0 -0 PE(34:2)+H PE(34:2)+H PE (34:2) (34:2) 716.5224834700001 C39 H75 O8 N1 P1 6.13851003964E8 1.72388234417E8 7.827465705363534 5.604409916938513 6.960185541513954 0.93 22.65617852884372 0.0 0.0 5.67052776087E8 0.0 0.0 0.0 0.0 0.0 6.13851003964E8 0.0 0.0 0.0 0.0 0.0 1.56215682463E8 0.0 0.0 0.0 0.0 0.0 1.72388234417E8 0.0 0.0 0.0 7.826 7.827 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.86 0.85 -5309 -5308 2123 -5307 -5306 -5305 -5304 -5303 2222 -5302 -5301 -5300 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 716.521918 716.521978 7.827465705363534 7.827465705363534 7.826 7.827465705363534 7.827465705363534 7.827465705363534 7.827465705363534 7.827465705363534 7.827 7.827465705363534 7.827465705363534 7.827465705363534 4.1426792E7 7.253564E7 1 1 1 1 1 1 1 1 1 1 1 1 716.5224834700001 716.5224834700001 5.654700000832236E-4 716.5224834700001 716.5224834700001 716.5224834700001 716.5224834700001 716.5224834700001 5.054700001210222E-4 716.5224834700001 716.5224834700001 716.5224834700001 1000000.0 1000000.0 0.7891866802905412 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7054489032543884 1000000.0 1000000.0 1000000.0 0.0 0.0 11.782488209625244 0.0 0.0 0.0 0.0 0.0 12.716154221296318 0.0 0.0 0.0 C C 0.0 0.0 55.058356119744126 0.0 0.0 0.0 0.0 0.0 59.98185953441658 0.0 0.0 0.0 0.93 0.93 23.976407114184738 22.65617852884372 36.3599 32.3164 0 0 15 0 0 0 0 0 15 0 0 0 -0 PE(16:0p_18:2)+H PE(34:2p)+H PE (16:0p_18:2) (16:0p) (18:2) 700.5275684700001 C39 H75 O7 N1 P1 2.5852553081E7 9668870.7 8.041502838674935 0.4057509375140912 3.391333676561604 1.0 139.68248975049056 0.0 0.0 2.5852553081E7 0.0 0.0 0.0 0.0 0.0 2.5704630757E7 0.0 0.0 0.0 0.0 0.0 9668870.7 0.0 0.0 0.0 0.0 0.0 9216004.769 0.0 0.0 0.0 8.041 8.044 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.92 0.93 -5319 -5318 2248 -5317 -5316 -5315 -5314 -5313 2348 -5312 -5311 -5310 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 700.52717 700.526772 8.041502838674935 8.041502838674935 8.041 8.041502838674935 8.041502838674935 8.041502838674935 8.041502838674935 8.041502838674935 8.044 8.041502838674935 8.041502838674935 8.041502838674935 1.0943989E7 9177677.0 1 1 1 1 1 1 1 1 1 1 1 1 700.5275684700001 700.5275684700001 3.984700001637975E-4 700.5275684700001 700.5275684700001 700.5275684700001 700.5275684700001 700.5275684700001 7.964700000684388E-4 700.5275684700001 700.5275684700001 700.5275684700001 1000000.0 1000000.0 0.5688141596398313 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.136957395992257 1000000.0 1000000.0 1000000.0 0.0 0.0 17.00819804189856 0.0 0.0 0.0 0.0 0.0 17.14349158680585 0.0 0.0 0.0 B B 0.0 0.0 54.513455262495384 0.0 0.0 0.0 0.0 0.0 55.12376716014743 0.0 0.0 0.0 1.0 0.99 139.68248975049056 47.48964080527468 11.7532 12.5207 0 0 12 0 0 0 0 0 10 0 0 0 -0 PE(34:3)+Na PE(34:3)+Na PE (34:3) (34:3) 736.48877847 C39 H72 O8 N1 P1 Na1 9.9563606432E7 3.6195557656E7 7.498049906677505 8.96157687203539 7.401731616926568 0.99 36.96603173348195 0.0 0.0 9.9563606432E7 0.0 0.0 0.0 0.0 0.0 8.7697274339E7 0.0 0.0 0.0 0.0 0.0 3.6195557656E7 0.0 0.0 0.0 0.0 0.0 3.2595178073E7 0.0 0.0 0.0 7.489 7.491 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 1.0 0.89 -5329 -5328 1980 -5327 -5326 -5325 -5324 -5323 2079 -5322 -5321 -5320 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.488724 736.488437 7.498049906677505 7.498049906677505 7.489 7.498049906677505 7.498049906677505 7.498049906677505 7.498049906677505 7.498049906677505 7.491 7.498049906677505 7.498049906677505 7.498049906677505 6739823.5 2.0566506E7 1 1 1 1 1 1 1 1 1 1 1 1 736.48877847 736.48877847 5.447000000913249E-5 736.48877847 736.48877847 736.48877847 736.48877847 736.48877847 3.41470000080335E-4 736.48877847 736.48877847 736.48877847 1000000.0 1000000.0 0.07395903590315361 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.46364589666893935 1000000.0 1000000.0 1000000.0 0.0 0.0 40.25088561510752 0.0 0.0 0.0 0.0 0.0 42.26120527761819 0.0 0.0 0.0 C C 0.0 0.0 66.09340823498772 0.0 0.0 0.0 0.0 0.0 69.1672754134504 0.0 0.0 0.0 0.99 0.99 36.96603173348195 37.63793405651982 12.377 12.5236 0 0 13 0 0 0 0 0 13 0 0 0 -0 PE(34:3)+H PE(34:3)+H PE (34:3) (34:3) 714.5068334700001 C39 H73 O8 N1 P1 1.622434974272E9 5.91125633166E8 7.498049906677505 5.847083402523849 3.2541305256873585 1.0 162.8217728695588 0.0 0.0 1.493602039898E9 0.0 0.0 0.0 0.0 0.0 1.622434974272E9 0.0 0.0 0.0 0.0 0.0 5.64533706497E8 0.0 0.0 0.0 0.0 0.0 5.91125633166E8 0.0 0.0 0.0 7.499 7.499 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.92 0.92 -5340 -5339 -5338 -5337 -5336 -5335 -5334 -5333 2136 -5332 -5331 -5330 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 714.50683 714.507057 7.498049906677505 7.498049906677505 7.499 7.498049906677505 7.498049906677505 7.498049906677505 7.498049906677505 7.498049906677505 7.499 7.498049906677505 7.498049906677505 7.498049906677505 1.7564206E7 1 1 1 1 1 1 1 1 1 1 1 1 714.5068334700001 714.5068334700001 3.470000024208275E-6 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 714.5068334700001 2.23529999971106E-4 714.5068334700001 714.5068334700001 714.5068334700001 1000000.0 1000000.0 0.004856496623490963 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3128451534683486 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.295929545625178 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 53.535211116707 0.0 0.0 0.0 0.99 1.0 214.98986228721853 162.8217728695588 15.5601 22.6603 0 0 13 0 0 0 0 0 14 0 0 0 -0 PE(16:0p_18:3)+H PE(34:3p)+H PE (16:0p_18:3) (16:0p) (18:3) 698.5119184700001 C39 H73 O7 N1 P1 2.18139947213E8 7.9802287287E7 7.727513930875095 8.696470042109015 9.194450998978255 0.98 140.06410295312432 0.0 0.0 2.18139947213E8 0.0 0.0 0.0 0.0 0.0 1.92865833366E8 0.0 0.0 0.0 0.0 0.0 7.9802287287E7 0.0 0.0 0.0 0.0 0.0 7.0059110478E7 0.0 0.0 0.0 7.73 7.729 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 1.0 0.81 -5350 -5349 2084 -5348 -5347 -5346 -5345 -5344 2170 -5343 -5342 -5341 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 698.51205 698.511644 7.727513930875095 7.727513930875095 7.73 7.727513930875095 7.727513930875095 7.727513930875095 7.727513930875095 7.727513930875095 7.729 7.727513930875095 7.727513930875095 7.727513930875095 2898613.5 3174913.5 1 1 1 1 1 1 1 1 1 1 1 1 698.5119184700001 698.5119184700001 1.3152999997601E-4 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 698.5119184700001 2.744700000221201E-4 698.5119184700001 698.5119184700001 698.5119184700001 1000000.0 1000000.0 0.18830029452340546 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3929353140076852 1000000.0 1000000.0 1000000.0 0.0 0.0 17.222427560171447 0.0 0.0 0.0 0.0 0.0 22.183599919953675 0.0 0.0 0.0 B B 0.0 0.0 55.37758057932941 0.0 0.0 0.0 0.0 0.0 53.97469566898706 0.0 0.0 0.0 0.98 0.98 140.06410295312432 285.34286893973945 16.6161 12.7944 0 0 14 0 0 0 0 0 14 0 0 0 -0 PE(34:4)+Na PE(34:4)+Na PE (34:4) (34:4) 734.4731284700001 C39 H70 O8 N1 P1 Na1 3.4422902233E7 7615918.311 7.060918521112396 1.7009019720504175 2.528240016849287 0.71 29.138096924287552 0.0 0.0 3.4422902233E7 0.0 0.0 0.0 0.0 0.0 3.3604720868E7 0.0 0.0 0.0 0.0 0.0 7615918.311 0.0 0.0 0.0 0.0 0.0 7348395.929 0.0 0.0 0.0 7.061 7.059 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5360 -5359 1793 -5358 -5357 -5356 -5355 -5354 1887 -5353 -5352 -5351 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 734.472257 734.472979 7.060918521112396 7.060918521112396 7.061 7.060918521112396 7.060918521112396 7.060918521112396 7.060918521112396 7.060918521112396 7.059 7.060918521112396 7.060918521112396 7.060918521112396 7331051.5 6252086.5 1 1 1 1 1 1 1 1 1 1 1 1 734.4731284700001 734.4731284700001 8.714700001064557E-4 734.4731284700001 734.4731284700001 734.4731284700001 734.4731284700001 734.4731284700001 1.4947000011034106E-4 734.4731284700001 734.4731284700001 734.4731284700001 1000000.0 1000000.0 1.1865240079263857 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.20350642428771476 1000000.0 1000000.0 1000000.0 0.0 0.0 33.11909611864852 0.0 0.0 0.0 0.0 0.0 31.39012713113515 0.0 0.0 0.0 C C 0.0 0.0 65.06698648064543 0.0 0.0 0.0 0.0 0.0 61.67019082737751 0.0 0.0 0.0 0.71 0.53 29.138096924287552 21.551235455796686 4.0533 4.4004 0 0 14 0 0 0 0 0 15 0 0 0 -0 PE(34:4)+H PE(34:4)+H PE (34:4) (34:4) 712.4911834700001 C39 H71 O8 N1 P1 4.19107805219E8 7.4141590176E7 7.060918521112396 1.6894207760824242 5.252531061954676 0.68 7.4183304E7 0.0 0.0 4.09212681339E8 0.0 0.0 0.0 0.0 0.0 4.19107805219E8 0.0 0.0 0.0 0.0 0.0 6.8831428803E7 0.0 0.0 0.0 0.0 0.0 7.4141590176E7 0.0 0.0 0.0 7.064 7.06 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5370 -5369 1783 -5368 -5367 -5366 -5365 -5364 1879 -5363 -5362 -5361 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 712.49035 712.49123 7.060918521112396 7.060918521112396 7.064 7.060918521112396 7.060918521112396 7.060918521112396 7.060918521112396 7.060918521112396 7.06 7.060918521112396 7.060918521112396 7.060918521112396 9060627.0 5608670.0 1 1 1 1 1 1 1 1 1 1 1 1 712.4911834700001 712.4911834700001 8.334700000887096E-4 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 712.4911834700001 4.652999984955386E-5 712.4911834700001 712.4911834700001 712.4911834700001 1000000.0 1000000.0 1.169796931422385 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.06530607104910659 1000000.0 1000000.0 1000000.0 0.0 0.0 12.367707271621995 0.0 0.0 0.0 0.0 0.0 11.644203171461527 0.0 0.0 0.0 C C 0.0 0.0 57.524219868009276 0.0 0.0 0.0 0.0 0.0 54.41216435262395 0.0 0.0 0.0 0.76 0.68 73.875306315497 7.4183304E7 32.0391 33.6147 0 0 18 0 0 0 0 0 18 0 0 0 -0 PE(34:4e)+Na PE(34:4e)+Na PE (34:4e) (34:4e) 720.4938634700001 C39 H72 O7 N1 P1 Na1 3.2865011314E7 1.2520580394E7 7.7279234222137205 2.5484583558557468 3.3661986404866457 0.98 1.1769873E7 0.0 0.0 3.1701501964E7 0.0 0.0 0.0 0.0 0.0 3.2865011314E7 0.0 0.0 0.0 0.0 0.0 1.2520580394E7 0.0 0.0 0.0 0.0 0.0 1.1938392778E7 0.0 0.0 0.0 7.73 7.725 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5380 -5379 2102 -5378 -5377 -5376 -5375 -5374 2193 -5373 -5372 -5371 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 720.493778 720.493547 7.7279234222137205 7.7279234222137205 7.73 7.7279234222137205 7.7279234222137205 7.7279234222137205 7.7279234222137205 7.7279234222137205 7.725 7.7279234222137205 7.7279234222137205 7.7279234222137205 6784754.5 8796712.0 1 1 1 1 1 1 1 1 1 1 1 1 720.4938634700001 720.4938634700001 8.547000004455185E-5 720.4938634700001 720.4938634700001 720.4938634700001 720.4938634700001 720.4938634700001 3.164700000297671E-4 720.4938634700001 720.4938634700001 720.4938634700001 1000000.0 1000000.0 0.11862696461135182 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4392403822922279 1000000.0 1000000.0 1000000.0 0.0 0.0 15.305711156509867 0.0 0.0 0.0 0.0 0.0 9.624422440282613 0.0 0.0 0.0 C C 0.0 0.0 30.01119834609779 0.0 0.0 0.0 0.0 0.0 31.248124806112383 0.0 0.0 0.0 0.98 0.98 1.2487356E7 1.1769873E7 7.5482 9.8164 0 0 13 0 0 0 0 0 14 0 0 0 -0 PE(34:5)+Na PE(34:5)+Na PE (34:5) (34:5) 732.4574784700001 C39 H68 O8 N1 P1 Na1 1.9415216237E7 7976225.707 6.691054353407174 1.4975016863244643 11.960642513979142 1.0 142.26026884775632 0.0 0.0 1.9008351538E7 0.0 0.0 0.0 0.0 0.0 1.9415216237E7 0.0 0.0 0.0 0.0 0.0 6732262.464 0.0 0.0 0.0 0.0 0.0 7976225.707 0.0 0.0 0.0 6.695 6.69 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5390 -5389 1612 -5388 -5387 -5386 -5385 -5384 1713 -5383 -5382 -5381 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 732.4571 732.456735 6.691054353407174 6.691054353407174 6.695 6.691054353407174 6.691054353407174 6.691054353407174 6.691054353407174 6.691054353407174 6.69 6.691054353407174 6.691054353407174 6.691054353407174 3215087.25 4354285.5 1 1 1 1 1 1 1 1 1 1 1 1 732.4574784700001 732.4574784700001 3.7847000010060583E-4 732.4574784700001 732.4574784700001 732.4574784700001 732.4574784700001 732.4574784700001 7.434700000885641E-4 732.4574784700001 732.4574784700001 732.4574784700001 1000000.0 1000000.0 0.516712589092784 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0150350319878876 1000000.0 1000000.0 1000000.0 0.0 0.0 25.64824784086959 0.0 0.0 0.0 0.0 0.0 31.83159407702583 0.0 0.0 0.0 C C 0.0 0.0 63.173024238595055 0.0 0.0 0.0 0.0 0.0 62.90828868977435 0.0 0.0 0.0 1.0 1.0 124.34368481393533 142.26026884775632 10.5507 12.0237 0 0 10 0 0 0 0 0 9 0 0 0 -0 PE(34:5)+H PE(34:5)+H PE (34:5) (34:5) 710.4755334700001 C39 H69 O8 N1 P1 1.48367759697E8 4.9193062698E7 6.691054353407174 3.0123776990512834 4.131787825077251 1.0 100.43783634499043 0.0 0.0 1.48367759697E8 0.0 0.0 0.0 0.0 0.0 1.42178904526E8 0.0 0.0 0.0 0.0 0.0 4.6400195545E7 0.0 0.0 0.0 0.0 0.0 4.9193062698E7 0.0 0.0 0.0 6.69 6.69 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.96 0.94 -5400 -5399 1607 -5398 -5397 -5396 -5395 -5394 1705 -5393 -5392 -5391 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 710.475798 710.475859 6.691054353407174 6.691054353407174 6.69 6.691054353407174 6.691054353407174 6.691054353407174 6.691054353407174 6.691054353407174 6.69 6.691054353407174 6.691054353407174 6.691054353407174 5053390.5 2694247.75 1 1 1 1 1 1 1 1 1 1 1 1 710.4755334700001 710.4755334700001 2.645299999812778E-4 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 710.4755334700001 3.2552999994095444E-4 710.4755334700001 710.4755334700001 710.4755334700001 1000000.0 1000000.0 0.3723280922698341 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4581860804566326 1000000.0 1000000.0 1000000.0 0.0 0.0 10.87985892917126 0.0 0.0 0.0 0.0 0.0 11.02733589790747 0.0 0.0 0.0 C C 0.0 0.0 51.32008928854367 0.0 0.0 0.0 0.0 0.0 52.015735367488055 0.0 0.0 0.0 1.0 1.0 100.43783634499043 119.1407247399403 36.0538 27.9037 0 0 11 0 0 0 0 0 11 0 0 0 -0 PE(34:6)+Na PE(34:6)+Na PE (34:6) (34:6) 730.4418284700001 C39 H66 O8 N1 P1 Na1 2.2352142044E7 7287496.223 6.236680378790541 7.010245313216094 4.184687456665232 1.0 216.8164378839555 0.0 0.0 2.0240812686E7 0.0 0.0 0.0 0.0 0.0 2.2352142044E7 0.0 0.0 0.0 0.0 0.0 6868613.967 0.0 0.0 0.0 0.0 0.0 7287496.223 0.0 0.0 0.0 6.235 6.238 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.93 0.95 -5410 -5409 1432 -5408 -5407 -5406 -5405 -5404 1526 -5403 -5402 -5401 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 730.441763 730.441596 6.236680378790541 6.236680378790541 6.235 6.236680378790541 6.236680378790541 6.236680378790541 6.236680378790541 6.236680378790541 6.238 6.236680378790541 6.236680378790541 6.236680378790541 3969195.5 1938800.125 1 1 1 1 1 1 1 1 1 1 1 1 730.4418284700001 730.4418284700001 6.5470000095047E-5 730.4418284700001 730.4418284700001 730.4418284700001 730.4418284700001 730.4418284700001 2.3247000012815988E-4 730.4418284700001 730.4418284700001 730.4418284700001 1000000.0 1000000.0 0.08963068316087804 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.31825943020691566 1000000.0 1000000.0 1000000.0 0.0 0.0 30.347935525583665 0.0 0.0 0.0 0.0 0.0 31.105040814250074 0.0 0.0 0.0 C C 0.0 0.0 59.85786099720644 0.0 0.0 0.0 0.0 0.0 51.32845018853147 0.0 0.0 0.0 0.99 1.0 246.30731355246724 216.8164378839555 33.1454 41.3255 0 0 11 0 0 0 0 0 10 0 0 0 -0 PE(34:6)+H PE(34:6)+H PE (34:6) (34:6) 708.4598834700001 C39 H67 O8 N1 P1 1.61302563257E8 6.0109895271E7 6.236680378790541 4.866598756604038 2.216993829974181 0.99 3148.9060732728767 0.0 0.0 1.50570376129E8 0.0 0.0 0.0 0.0 0.0 1.61302563257E8 0.0 0.0 0.0 0.0 0.0 5.8254356456E7 0.0 0.0 0.0 0.0 0.0 6.0109895271E7 0.0 0.0 0.0 6.232 6.238 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5421 -5420 -5419 -5418 -5417 -5416 -5415 -5414 1543 -5413 -5412 -5411 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 708.45988 708.459043 6.236680378790541 6.236680378790541 6.232 6.236680378790541 6.236680378790541 6.236680378790541 6.236680378790541 6.236680378790541 6.238 6.236680378790541 6.236680378790541 6.236680378790541 3.168195E7 1 1 1 1 1 1 1 1 1 1 1 1 708.4598834700001 708.4598834700001 3.470000137895113E-6 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 708.4598834700001 8.404700001847232E-4 708.4598834700001 708.4598834700001 708.4598834700001 1000000.0 1000000.0 0.0048979486613966484 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1863339333599867 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.734967224322081 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 53.1015483733526 0.0 0.0 0.0 0.99 0.99 4365.313114279554 3148.9060732728767 67.8937 75.106 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(35:2)+Na PE(35:2)+Na PE (35:2) (35:2) 752.52007847 C40 H76 O8 N1 P1 Na1 7636016.510099999 2239747.25 8.001658665985293 30.958230062625073 14.255985823659081 0.6589643283635607 2239747.25 0.0 0.0 7636016.510099999 0.0 0.0 0.0 0.0 0.0 4893260.700599963 0.0 0.0 0.0 0.0 0.0 2239747.25 0.0 0.0 0.0 0.0 0.0 1829542.34 0.0 0.0 0.0 7.993 7.996 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.86 0.94 -5432 -5431 2227 -5430 -5429 -5428 -5427 -5426 -5425 -5424 -5423 -5422 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 752.520386 752.52008 8.001658665985293 8.001658665985293 7.993 8.001658665985293 8.001658665985293 8.001658665985293 8.001658665985293 8.001658665985293 7.996 8.001658665985293 8.001658665985293 8.001658665985293 1786966.25 1 1 1 1 1 1 1 1 1 1 1 1 752.52007847 752.52007847 3.0752999998640007E-4 752.52007847 752.52007847 752.52007847 752.52007847 752.52007847 1.5299999631679384E-6 752.52007847 752.52007847 752.52007847 1000000.0 1000000.0 0.40866683665326287 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002033168292703479 1000000.0 1000000.0 1000000.0 0.0 0.0 17.32278193746275 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 42.35399006714609 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.6589643283635607 0.6777406553511431 2239747.25 2145131.5 1.7879 2.0108 0 0 9 0 0 0 0 0 8 0 0 0 -0 PE(35:2)+H PE(35:2)+H PE (35:2) (35:2) 730.53813347 C40 H77 O8 N1 P1 4.892190968249978E7 1.5728317E7 8.001658665985293 9.80608350423251 5.060081732222351 0.45024607451460985 1.0653083769381522 0.0 0.0 4.2577395322499916E7 0.0 0.0 0.0 0.0 0.0 4.892190968249978E7 0.0 0.0 0.0 0.0 0.0 1.464167325E7 0.0 0.0 0.0 0.0 0.0 1.5728317E7 0.0 0.0 0.0 7.984 7.987 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.84 0.85 -5443 -5442 -5441 -5440 -5439 -5438 -5437 -5436 2305 -5435 -5434 -5433 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 730.53813 730.537964 8.001658665985293 8.001658665985293 7.984 8.001658665985293 8.001658665985293 8.001658665985293 8.001658665985293 8.001658665985293 7.987 8.001658665985293 8.001658665985293 8.001658665985293 8757971.0 1 1 1 1 1 1 1 1 1 1 1 1 730.53813347 730.53813347 3.470000024208275E-6 730.53813347 730.53813347 730.53813347 730.53813347 730.53813347 1.6947000005984592E-4 730.53813347 730.53813347 730.53813347 1000000.0 1000000.0 0.004749923193914658 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.23197967675537542 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.624022150366565 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 40.299168926946564 0.0 0.0 0.0 0.4218820559159797 0.45024607451460985 1.6372494E7 1.0653083769381522 3.434 3.7636 0 0 11 0 0 0 0 0 12 0 0 0 -0 PE(35:3)+Na PE(35:3)+Na PE (35:3) (35:3) 750.5044284700001 C40 H74 O8 N1 P1 Na1 1.4774996642E7 5324277.202 7.704889960813803 6.25193780689132 10.731507404457796 0.97 2.0722955618040513 0.0 0.0 1.3523959876E7 0.0 0.0 0.0 0.0 0.0 1.4774996642E7 0.0 0.0 0.0 0.0 0.0 4573223.047 0.0 0.0 0.0 0.0 0.0 5324277.202 0.0 0.0 0.0 7.721 7.725 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5453 -5452 2079 -5451 -5450 -5449 -5448 -5447 2168 -5446 -5445 -5444 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 750.504906 750.5047 7.704889960813803 7.704889960813803 7.721 7.704889960813803 7.704889960813803 7.704889960813803 7.704889960813803 7.704889960813803 7.725 7.704889960813803 7.704889960813803 7.704889960813803 3151006.5 3314298.25 1 1 1 1 1 1 1 1 1 1 1 1 750.5044284700001 750.5044284700001 4.7752999989825184E-4 750.5044284700001 750.5044284700001 750.5044284700001 750.5044284700001 750.5044284700001 2.7152999984991766E-4 750.5044284700001 750.5044284700001 750.5044284700001 1000000.0 1000000.0 0.6362787237268649 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.361796665748484 1000000.0 1000000.0 1000000.0 0.0 0.0 24.369149025433966 0.0 0.0 0.0 0.0 0.0 33.50806894395283 0.0 0.0 0.0 C C 0.0 0.0 47.8765206786522 0.0 0.0 0.0 0.0 0.0 54.84135670041379 0.0 0.0 0.0 0.92 0.97 0.952830086884909 2.0722955618040513 5.8731 5.9244 0 0 9 0 0 0 0 0 10 0 0 0 -0 PE(35:3)+H PE(35:3)+H PE (35:3) (35:3) 728.5224834700001 C40 H75 O8 N1 P1 7.0241211582E7 3.6265192177E7 7.704889960813803 2.5228580163985566 4.707017073406574 0.98 2.3799228948510063 0.0 0.0 7.0241211582E7 0.0 0.0 0.0 0.0 0.0 6.7779027122E7 0.0 0.0 0.0 0.0 0.0 3.3928878224E7 0.0 0.0 0.0 0.0 0.0 3.6265192177E7 0.0 0.0 0.0 7.726 7.723 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5464 -5463 -5462 -5461 -5460 -5459 -5458 -5457 2200 -5456 -5455 -5454 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 728.52248 728.52251 7.704889960813803 7.704889960813803 7.726 7.704889960813803 7.704889960813803 7.704889960813803 7.704889960813803 7.704889960813803 7.723 7.704889960813803 7.704889960813803 7.704889960813803 3.1980872E7 1 1 1 1 1 1 1 1 1 1 1 1 728.5224834700001 728.5224834700001 3.470000137895113E-6 728.5224834700001 728.5224834700001 728.5224834700001 728.5224834700001 728.5224834700001 2.6529999900049006E-5 728.5224834700001 728.5224834700001 728.5224834700001 1000000.0 1000000.0 0.004763065267893004 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.03641617177507671 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.851243258349417 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 42.148777420711504 0.0 0.0 0.0 0.98 0.99 2.3799228948510063 41.28881696383857 21.661 4.6197 0 0 9 0 0 0 0 0 8 0 0 0 -0 PE(35:4)+H PE(35:4)+H PE (35:4) (35:4) 726.5068334700001 C40 H73 O8 N1 P1 1.00956372962E8 2.6892229415E7 7.396 7.307672984343311 0.0037838185889024246 0.98 177.42319798825085 0.0 0.0 9.1035563781E7 0.0 0.0 0.0 0.0 0.0 1.00956372962E8 0.0 0.0 0.0 0.0 0.0 2.6892229415E7 0.0 0.0 0.0 0.0 0.0 2.6890790416E7 0.0 0.0 0.0 7.401 7.397 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.92 0.95 -5475 -5474 -5473 -5472 -5471 -5470 -5469 -5468 2051 -5467 -5466 -5465 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 726.50683 726.506401 7.396 7.396 7.401 7.396 7.396 7.396 7.396 7.396 7.397 7.396 7.396 7.396 2.4168744E7 1 1 1 1 1 1 1 1 1 1 1 1 726.5068334700001 726.5068334700001 3.470000024208275E-6 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 726.5068334700001 4.324700000779558E-4 726.5068334700001 726.5068334700001 726.5068334700001 1000000.0 1000000.0 0.004776279952708198 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5952731346136938 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.418362151399178 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 45.063933738752056 0.0 0.0 0.0 0.96 0.98 3.1929086E7 177.42319798825085 11.4434 13.2971 0 0 13 0 0 0 0 0 13 0 0 0 -0 PE(35:5)+H PE(35:5)+H PE (35:5) (35:5) 724.4911834700001 C40 H71 O8 N1 P1 4.3664205557E7 1.1573303246E7 6.922 0.14196120284403724 11.491233688559715 0.99 23.688759665350318 0.0 0.0 4.3664205557E7 0.0 0.0 0.0 0.0 0.0 4.3576631696E7 0.0 0.0 0.0 0.0 0.0 1.1573303246E7 0.0 0.0 0.0 0.0 0.0 9833858.087 0.0 0.0 0.0 6.926 6.921 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5486 -5485 -5484 -5483 -5482 -5481 -5480 -5479 1802 -5478 -5477 -5476 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 724.48878 724.491699 6.922 6.922 6.926 6.922 6.922 6.922 6.922 6.922 6.921 6.922 6.922 6.922 1460281.125 1 1 1 1 1 1 1 1 1 1 1 1 724.4911834700001 724.4911834700001 0.00240347000010388 724.4911834700001 724.4911834700001 724.4911834700001 724.4911834700001 724.4911834700001 5.155299999159979E-4 724.4911834700001 724.4911834700001 724.4911834700001 1000000.0 1000000.0 3.317459280308003 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7115752567848124 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.30168966814028 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 34.60516430398236 0.0 0.0 0.0 0.99 0.98 23.688759665350318 13.867945203356376 6.1999 4.8985 0 0 23 0 0 0 0 0 22 0 0 0 -0 PE(35:6)+H PE(35:6)+H PE (35:6) (35:6) 722.4755334700001 C40 H69 O8 N1 P1 7899767.951 1783261.276 6.5114728372419615 2.8196843456214133 1.305179595573617 0.98 1855085.5 0.0 0.0 7590911.998 0.0 0.0 0.0 0.0 0.0 7899767.951 0.0 0.0 0.0 0.0 0.0 1783261.276 0.0 0.0 0.0 0.0 0.0 1750646.791 0.0 0.0 0.0 6.505 6.515 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.73 0.75 -5496 -5495 1544 -5494 -5493 -5492 -5491 -5490 1644 -5489 -5488 -5487 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 722.47455 722.474713 6.5114728372419615 6.5114728372419615 6.505 6.5114728372419615 6.5114728372419615 6.5114728372419615 6.5114728372419615 6.5114728372419615 6.515 6.5114728372419615 6.5114728372419615 6.5114728372419615 1186462.25 1455681.125 1 1 1 1 1 1 1 1 1 1 1 1 722.4755334700001 722.4755334700001 9.834700000510566E-4 722.4755334700001 722.4755334700001 722.4755334700001 722.4755334700001 722.4755334700001 8.204700001215315E-4 722.4755334700001 722.4755334700001 722.4755334700001 1000000.0 1000000.0 1.3612502493025862 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1356370729689222 1000000.0 1000000.0 1000000.0 0.0 0.0 9.323241711348505 0.0 0.0 0.0 0.0 0.0 13.926263473151485 0.0 0.0 0.0 C C 0.0 0.0 44.60881201602156 0.0 0.0 0.0 0.0 0.0 44.9234305585532 0.0 0.0 0.0 0.94 0.98 1926922.88 1855085.5 6.5738 5.8532 0 0 26 0 0 0 0 0 28 0 0 0 -0 PE(36:2)+Na PE(36:2)+Na PE (36:2) (36:2) 766.5357284700001 C41 H78 O8 N1 P1 Na1 9.1354734267E7 2.6695380806E7 8.179274334560658 7.710292536127422 10.73014414589905 0.97 1.6492817184150805 0.0 0.0 8.1908426504E7 0.0 0.0 0.0 0.0 0.0 9.1354734267E7 0.0 0.0 0.0 0.0 0.0 2.2930116798E7 0.0 0.0 0.0 0.0 0.0 2.6695380806E7 0.0 0.0 0.0 8.177 8.177 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.75 1.0 -5517 -5516 2305 -5515 -5514 -5513 -5512 -5511 2397 -5510 -5509 -5508 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 766.534774 766.534272 8.179274334560658 8.179274334560658 8.177 8.179274334560658 8.179274334560658 8.179274334560658 8.179274334560658 8.179274334560658 8.177 8.179274334560658 8.179274334560658 8.179274334560658 1.2428715E7 1.4268574E7 1 1 1 1 1 1 1 1 1 1 1 1 766.5357284700001 766.5357284700001 9.544700001242745E-4 766.5357284700001 766.5357284700001 766.5357284700001 766.5357284700001 766.5357284700001 0.0014564700001074016 766.5357284700001 766.5357284700001 766.5357284700001 1000000.0 1000000.0 1.2451735316100527 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.9000679890218626 1000000.0 1000000.0 1000000.0 0.0 0.0 36.549916839693644 0.0 0.0 0.0 0.0 0.0 42.065354240884375 0.0 0.0 0.0 C C 0.0 0.0 71.66650360724245 0.0 0.0 0.0 0.0 0.0 69.1864378961914 0.0 0.0 0.0 0.95 0.97 2.5432902E7 1.6492817184150805 10.0835 21.8721 0 0 13 0 0 0 0 0 13 0 0 0 -0 PE(36:2)+H PE(36:2)+H PE (36:2) (36:2) 744.5537834700001 C41 H79 O8 N1 P1 5.29993567314E8 1.55615985726E8 8.179274334560658 2.7777298462527185 2.1604859542140904 0.97 526.3391888552528 0.0 0.0 5.09574867165E8 0.0 0.0 0.0 0.0 0.0 5.29993567314E8 0.0 0.0 0.0 0.0 0.0 1.5093285663E8 0.0 0.0 0.0 0.0 0.0 1.55615985726E8 0.0 0.0 0.0 8.173 8.18 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5528 -5527 -5526 -5525 -5524 -5523 -5522 -5521 2398 -5520 -5519 -5518 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 744.55378 744.554188 8.179274334560658 8.179274334560658 8.173 8.179274334560658 8.179274334560658 8.179274334560658 8.179274334560658 8.179274334560658 8.18 8.179274334560658 8.179274334560658 8.179274334560658 1.31787248E8 1 1 1 1 1 1 1 1 1 1 1 1 744.5537834700001 744.5537834700001 3.470000137895113E-6 744.5537834700001 744.5537834700001 744.5537834700001 744.5537834700001 744.5537834700001 4.0452999985518545E-4 744.5537834700001 744.5537834700001 744.5537834700001 1000000.0 1000000.0 0.004660509710558643 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5433187082467964 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.84329363778458 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.34249363450737 0.0 0.0 0.0 0.95 0.97 151.82972548224174 526.3391888552528 58.2712 46.7658 0 0 13 0 0 0 0 0 12 0 0 0 -0 PE(36:3)+Na PE(36:3)+Na PE (36:3) (36:3) 764.52007847 C41 H76 O8 N1 P1 Na1 1.88028688727E8 6.3403242189E7 7.253 1.9873193843578507 1.6631448203161203 0.86 54.525327296881294 0.0 0.0 1.82817385348E8 0.0 0.0 0.0 0.0 0.0 1.88028688727E8 0.0 0.0 0.0 0.0 0.0 6.3403242189E7 0.0 0.0 0.0 0.0 0.0 6.1929305137E7 0.0 0.0 0.0 7.253 7.25 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.78 0.79 -5539 -5538 1864 -5537 -5536 -5535 -5534 -5533 -5532 -5531 -5530 -5529 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 764.523193 764.52008 7.253 7.253 7.253 7.253 7.253 7.253 7.253 7.253 7.25 7.253 7.253 7.253 3077367.25 1 1 1 1 1 1 1 1 1 1 1 1 764.52007847 764.52007847 0.0031145299999479903 764.52007847 764.52007847 764.52007847 764.52007847 764.52007847 1.5299999631679384E-6 764.52007847 764.52007847 764.52007847 1000000.0 1000000.0 4.073836760678621 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002001255436259907 1000000.0 1000000.0 1000000.0 0.0 0.0 11.651556152891681 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 54.70214156287175 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.86 10.565965799600816 54.525327296881294 3.8432 3.5082 0 0 9 0 0 0 0 0 14 0 0 0 -0 PE(18:0_18:3)+H PE(36:3)+H PE (18:0_18:3) (18:0) (18:3) 742.53813347 C41 H77 O8 N1 P1 9.86164581629E8 3.59815509266E8 7.859456040131504 4.4258991959971405 3.922652527109821 0.99 705.8231941077161 0.0 0.0 9.26312032248E8 0.0 0.0 0.0 0.0 0.0 9.86164581629E8 0.0 0.0 0.0 0.0 0.0 3.59815509266E8 0.0 0.0 0.0 0.0 0.0 3.40393570533E8 0.0 0.0 0.0 7.861 7.862 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5549 -5548 2190 -5547 -5546 -5545 -5544 -5543 2247 -5542 -5541 -5540 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 742.539066 742.538034 7.859456040131504 7.859456040131504 7.861 7.859456040131504 7.859456040131504 7.859456040131504 7.859456040131504 7.859456040131504 7.862 7.859456040131504 7.859456040131504 7.859456040131504 8.0008936E7 7.3489384E7 1 1 1 1 1 1 1 1 1 1 1 1 742.53813347 742.53813347 9.325300000000425E-4 742.53813347 742.53813347 742.53813347 742.53813347 742.53813347 9.947000000920525E-5 742.53813347 742.53813347 742.53813347 1000000.0 1000000.0 1.2558681607935474 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.13395945006132676 1000000.0 1000000.0 1000000.0 0.0 0.0 10.808141008496627 0.0 0.0 0.0 0.0 0.0 12.193473809953623 0.0 0.0 0.0 B C 0.0 0.0 51.223417101879754 0.0 0.0 0.0 0.0 0.0 56.71383167420289 0.0 0.0 0.0 0.98 0.99 356.7318088467046 705.8231941077161 11.8044 12.6242 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(36:3)+Na PE(36:3)+Na PE (18:0_18:3) (18:0) (18:3) 764.52007847 C41 H76 O8 N1 P1 Na1 9.562814175E7 3.4603489056E7 7.859456040131504 4.06217930341467 5.87998507089472 0.97 134.3811748343929 0.0 0.0 9.0287899546E7 0.0 0.0 0.0 0.0 0.0 9.562814175E7 0.0 0.0 0.0 0.0 0.0 3.1840880145E7 0.0 0.0 0.0 0.0 0.0 3.4603489056E7 0.0 0.0 0.0 7.862 7.856 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5559 -5558 2156 -5557 -5556 -5555 -5554 -5553 2254 -5552 -5551 -5550 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 764.519806 764.519583 7.859456040131504 7.859456040131504 7.862 7.859456040131504 7.859456040131504 7.859456040131504 7.859456040131504 7.859456040131504 7.856 7.859456040131504 7.859456040131504 7.859456040131504 8206138.5 2.0799352E7 1 1 1 1 1 1 1 1 1 1 1 1 764.52007847 764.52007847 2.724700000271696E-4 764.52007847 764.52007847 764.52007847 764.52007847 764.52007847 4.954700000325829E-4 764.52007847 764.52007847 764.52007847 1000000.0 1000000.0 0.3563935175809269 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6480797744699458 1000000.0 1000000.0 1000000.0 0.0 0.0 42.89145623051766 0.0 0.0 0.0 0.0 0.0 34.32367749409056 0.0 0.0 0.0 C C 0.0 0.0 70.31386267297977 0.0 0.0 0.0 0.0 0.0 67.83335473140426 0.0 0.0 0.0 0.98 0.97 57.54841279114075 134.3811748343929 15.5995 6.0353 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(18:0p_18:3)+H PE(36:3p)+H PE (18:0p_18:3) (18:0p) (18:3) 726.54321847 C41 H77 O7 N1 P1 7.8390488359E7 2.9515248645E7 8.130981511012736 1.4836816582162686 1.3784156929616513 0.99 167.39224137804825 0.0 0.0 7.6762742669E7 0.0 0.0 0.0 0.0 0.0 7.8390488359E7 0.0 0.0 0.0 0.0 0.0 2.8945439865E7 0.0 0.0 0.0 0.0 0.0 2.9515248645E7 0.0 0.0 0.0 8.13 8.134 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.9 0.87 -5569 -5568 2281 -5567 -5566 -5565 -5564 -5563 2380 -5562 -5561 -5560 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 726.543052 726.542792 8.130981511012736 8.130981511012736 8.13 8.130981511012736 8.130981511012736 8.130981511012736 8.130981511012736 8.130981511012736 8.134 8.130981511012736 8.130981511012736 8.130981511012736 6953795.0 2.7809674E7 1 1 1 1 1 1 1 1 1 1 1 1 726.54321847 726.54321847 1.664700000674202E-4 726.54321847 726.54321847 726.54321847 726.54321847 726.54321847 4.264700000931043E-4 726.54321847 726.54321847 726.54321847 1000000.0 1000000.0 0.22912608064525478 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5869850399143377 1000000.0 1000000.0 1000000.0 0.0 0.0 16.451822423318475 0.0 0.0 0.0 0.0 0.0 17.74851286214164 0.0 0.0 0.0 B B 0.0 0.0 52.7302000747387 0.0 0.0 0.0 0.0 0.0 57.06917319016605 0.0 0.0 0.0 1.0 0.99 710.0212865860677 167.39224137804825 16.7203 13.6653 0 0 12 0 0 0 0 0 13 0 0 0 -0 PE(18:2_18:2)+Na PE(36:4)+Na PE (18:2_18:2) (18:2) (18:2) 762.5044284700001 C41 H74 O8 N1 P1 Na1 3.7772586754E7 1.3452349429E7 7.066 0.6564548198994643 2.3066973171578837 0.99 66.6060334335004 0.0 0.0 3.7423538631E7 0.0 0.0 0.0 0.0 0.0 3.7772586754E7 0.0 0.0 0.0 0.0 0.0 1.3452349429E7 0.0 0.0 0.0 0.0 0.0 1.3020554834E7 0.0 0.0 0.0 7.065 7.063 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5580 -5579 1788 -5578 -5577 -5576 -5575 -5574 -5573 -5572 -5571 -5570 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.505519 762.50443 7.066 7.066 7.065 7.066 7.066 7.066 7.066 7.066 7.063 7.066 7.066 7.066 4777842.0 1 1 1 1 1 1 1 1 1 1 1 1 762.5044284700001 762.5044284700001 0.0010905299999421914 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 1.5299998494811007E-6 762.5044284700001 762.5044284700001 762.5044284700001 1000000.0 1000000.0 1.4301949722841472 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020065455259730297 1000000.0 1000000.0 1000000.0 0.0 0.0 11.34547617010122 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 36.71675135955088 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 72.70091569821852 66.6060334335004 4.2201 4.3863 0 0 11 0 0 0 0 0 13 0 0 0 -0 PE(18:2_18:2)+H PE(36:4)+H PE (18:2_18:2) (18:2) (18:2) 740.5224834700001 C41 H75 O8 N1 P1 2.173645832997E9 5.75716894189E8 7.528844788176541 3.6489132542085163 5.9051654629803965 0.99 441.910772085749 0.0 0.0 2.173645832997E9 0.0 0.0 0.0 0.0 0.0 2.064299581449E9 0.0 0.0 0.0 0.0 0.0 5.75716894189E8 0.0 0.0 0.0 0.0 0.0 5.29564938916E8 0.0 0.0 0.0 7.534 7.532 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.95 0.91 -5591 -5590 -5589 -5588 -5587 -5586 -5585 -5584 2086 -5583 -5582 -5581 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 740.52248 740.522169 7.528844788176541 7.528844788176541 7.534 7.528844788176541 7.528844788176541 7.528844788176541 7.528844788176541 7.528844788176541 7.532 7.528844788176541 7.528844788176541 7.528844788176541 8.1817072E7 1 1 1 1 1 1 1 1 1 1 1 1 740.5224834700001 740.5224834700001 3.470000137895113E-6 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 740.5224834700001 3.1447000014850346E-4 740.5224834700001 740.5224834700001 740.5224834700001 1000000.0 1000000.0 0.004685880868377021 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.42465962501899274 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 23.441369367885088 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 56.07983102364853 0.0 0.0 0.0 0.99 0.99 441.910772085749 373.74947343234606 38.2194 36.5438 0 0 12 0 0 0 0 0 12 0 0 0 -0 PE(36:4)+Na PE(36:4)+Na PE (18:2_18:2) (18:2) (18:2) 762.5044284700001 C41 H74 O8 N1 P1 Na1 6.403470447E7 1.8085464461E7 7.528844788176541 1.6737595792121758 4.124015832860738 0.86 88.19929960088274 0.0 0.0 6.2536698065E7 0.0 0.0 0.0 0.0 0.0 6.403470447E7 0.0 0.0 0.0 0.0 0.0 1.7060564243E7 0.0 0.0 0.0 0.0 0.0 1.8085464461E7 0.0 0.0 0.0 7.519 7.513 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5602 -5601 -5600 -5599 -5598 -5597 -5596 -5595 2094 -5594 -5593 -5592 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.50443 762.503432 7.528844788176541 7.528844788176541 7.519 7.528844788176541 7.528844788176541 7.528844788176541 7.528844788176541 7.528844788176541 7.513 7.528844788176541 7.528844788176541 7.528844788176541 7811599.5 1 1 1 1 1 1 1 1 1 1 1 1 762.5044284700001 762.5044284700001 1.5299998494811007E-6 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 762.5044284700001 9.964700001319216E-4 762.5044284700001 762.5044284700001 762.5044284700001 1000000.0 1000000.0 0.0020065455259730297 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.3068383119182456 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 40.63976627927472 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 66.62256767094216 0.0 0.0 0.0 0.9 0.86 25.437998772910973 88.19929960088274 14.972 14.1461 0 0 15 0 0 0 0 0 14 0 0 0 -0 PE(36:5)+Na PE(36:5)+Na PE (36:5) (36:5) 760.48877847 C41 H72 O8 N1 P1 Na1 9.9595749289E7 3.5518120662E7 7.152180031005242 1.0695884922193997 1.944895403387104 0.99 31.682485400898877 0.0 0.0 9.9595749289E7 0.0 0.0 0.0 0.0 0.0 9.8100545962E7 0.0 0.0 0.0 0.0 0.0 3.5518120662E7 0.0 0.0 0.0 0.0 0.0 3.4554448545E7 0.0 0.0 0.0 7.155 7.156 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5612 -5611 1826 -5610 -5609 -5608 -5607 -5606 1923 -5605 -5604 -5603 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 760.48811 760.487939 7.152180031005242 7.152180031005242 7.155 7.152180031005242 7.152180031005242 7.152180031005242 7.152180031005242 7.152180031005242 7.156 7.152180031005242 7.152180031005242 7.152180031005242 6227953.0 5459272.0 1 1 1 1 1 1 1 1 1 1 1 1 760.48877847 760.48877847 6.684700000505472E-4 760.48877847 760.48877847 760.48877847 760.48877847 760.48877847 8.394700000735611E-4 760.48877847 760.48877847 760.48877847 1000000.0 1000000.0 0.8790004783442275 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1038558672258918 1000000.0 1000000.0 1000000.0 0.0 0.0 33.46661942889025 0.0 0.0 0.0 0.0 0.0 41.646208289072796 0.0 0.0 0.0 C C 0.0 0.0 65.74974347522642 0.0 0.0 0.0 0.0 0.0 68.27247260503736 0.0 0.0 0.0 0.99 0.98 31.682485400898877 350.9376180895091 36.4364 28.3535 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(36:5)+H PE(36:5)+H PE (36:5) (36:5) 738.5068334700001 C41 H73 O8 N1 P1 2.158219825976E9 7.37127322164E8 7.152180031005242 0.17615935902096413 0.4372402645295339 0.97 1037.4860680445547 0.0 0.0 2.15284980773E9 0.0 0.0 0.0 0.0 0.0 2.158219825976E9 0.0 0.0 0.0 0.0 0.0 7.37127322164E8 0.0 0.0 0.0 0.0 0.0 7.32583336064E8 0.0 0.0 0.0 7.156 7.157 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.94 0.85 -5622 -5621 1816 -5620 -5619 -5618 -5617 -5616 1912 -5615 -5614 -5613 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.505859 738.505676 7.152180031005242 7.152180031005242 7.156 7.152180031005242 7.152180031005242 7.152180031005242 7.152180031005242 7.152180031005242 7.157 7.152180031005242 7.152180031005242 7.152180031005242 4917360.5 3223409.0 1 1 1 1 1 1 1 1 1 1 1 1 738.5068334700001 738.5068334700001 9.744700000737794E-4 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 0.0011574700000664961 738.5068334700001 738.5068334700001 738.5068334700001 1000000.0 1000000.0 1.3195138567575146 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5673111576069327 1000000.0 1000000.0 1000000.0 0.0 0.0 11.919574134966627 0.0 0.0 0.0 0.0 0.0 11.733601090720049 0.0 0.0 0.0 C C 0.0 0.0 55.43987969751918 0.0 0.0 0.0 0.0 0.0 54.57488879404673 0.0 0.0 0.0 0.95 0.97 984.6836812918101 1037.4860680445547 68.9123 59.3888 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(16:0_20:5)+H PE(36:5)+H PE (16:0_20:5) (16:0) (20:5) 738.5068334700001 C41 H73 O8 N1 P1 2.3545077156E7 7780973.382 7.421 6.603400377384931 1.0986514193318448 0.86 3.590457991026966 0.0 0.0 2.3545077156E7 0.0 0.0 0.0 0.0 0.0 2.1444380287E7 0.0 0.0 0.0 0.0 0.0 7661010.191 0.0 0.0 0.0 0.0 0.0 7780973.382 0.0 0.0 0.0 7.422 7.42 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.92 0.91 -5633 -5632 1967 -5631 -5630 -5629 -5628 -5627 -5626 -5625 -5624 -5623 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 738.50717 738.50683 7.421 7.421 7.422 7.421 7.421 7.421 7.421 7.421 7.42 7.421 7.421 7.421 5778969.5 1 1 1 1 1 1 1 1 1 1 1 1 738.5068334700001 738.5068334700001 3.365299999131821E-4 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 738.5068334700001 3.470000024208275E-6 738.5068334700001 738.5068334700001 738.5068334700001 1000000.0 1000000.0 0.455689757577379 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004698670163827583 1000000.0 1000000.0 1000000.0 0.0 0.0 8.380189645901792 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 40.48400795121639 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.86 0.99 3.590457991026966 10.234467979261723 1.7734 3.4672 0 0 6 0 0 0 0 0 12 0 0 0 -0 PE(16:0p_20:5)+H PE(36:5p)+H PE (16:0p_20:5) (16:0p) (20:5) 722.5119184700001 C41 H73 O7 N1 P1 5566371.505 2194114.313 7.643 39.40649174420077 3.0059430861669423 0.98 26.134077386672512 0.0 0.0 5566371.505 0.0 0.0 0.0 0.0 0.0 3140294.159 0.0 0.0 0.0 0.0 0.0 2194114.313 0.0 0.0 0.0 0.0 0.0 2102782.788 0.0 0.0 0.0 7.642 7.646 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0070 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.95 0.5 -5644 -5643 2068 -5642 -5641 -5640 -5639 -5638 -5637 -5636 -5635 -5634 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 722.513587 722.51192 7.643 7.643 7.642 7.643 7.643 7.643 7.643 7.643 7.646 7.643 7.643 7.643 2241992.0 1 1 1 1 1 1 1 1 1 1 1 1 722.5119184700001 722.5119184700001 0.0016685299999608105 722.5119184700001 722.5119184700001 722.5119184700001 722.5119184700001 722.5119184700001 1.5299999631679384E-6 722.5119184700001 722.5119184700001 722.5119184700001 1000000.0 1000000.0 2.3093459876677325 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.002117612075393697 1000000.0 1000000.0 1000000.0 0.0 0.0 10.433644295084058 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 33.765839142666856 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.97 26.134077386672512 2468045.25 4.9194 4.4269 0 0 7 0 0 0 0 0 7 0 0 0 -0 PE(18:3_18:3)+H PE(36:6)+H PE (18:3_18:3) (18:3) (18:3) 736.4911834700001 C41 H71 O8 N1 P1 2.426256459407E9 9.34853858107E8 6.761787231140142 0.42590488753024974 5.2719256743491085 0.99 9.05726976E8 0.0 0.0 2.426256459407E9 0.0 0.0 0.0 0.0 0.0 2.411686499067E9 0.0 0.0 0.0 0.0 0.0 9.34853858107E8 0.0 0.0 0.0 0.0 0.0 8.67659505481E8 0.0 0.0 0.0 6.764 6.758 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5654 -5653 1636 -5652 -5651 -5650 -5649 -5648 1732 -5647 -5646 -5645 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 736.491454 736.491717 6.761787231140142 6.761787231140142 6.764 6.761787231140142 6.761787231140142 6.761787231140142 6.761787231140142 6.761787231140142 6.758 6.761787231140142 6.761787231140142 6.761787231140142 5644112.5 2412656.25 1 1 1 1 1 1 1 1 1 1 1 1 736.4911834700001 736.4911834700001 2.705299998524424E-4 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 736.4911834700001 5.335299998705523E-4 736.4911834700001 736.4911834700001 736.4911834700001 1000000.0 1000000.0 0.3673227947927798 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7244214348321317 1000000.0 1000000.0 1000000.0 0.0 0.0 22.01573661875714 0.0 0.0 0.0 0.0 0.0 23.10967029412378 0.0 0.0 0.0 A A 0.0 0.0 53.30686832628847 0.0 0.0 0.0 0.0 0.0 55.55209205318216 0.0 0.0 0.0 0.99 0.98 9.05726976E8 8.36420864E8 89.2456 73.9085 0 0 10 0 0 0 0 0 11 0 0 0 -0 PE(36:6)+Na PE(36:6)+Na PE (18:3_18:3) (18:3) (18:3) 758.4731284700001 C41 H70 O8 N1 P1 Na1 8.5442930589E7 2.9717343284E7 6.761787231140142 6.705843468629754 2.16606411677783 0.95 2178.9195804885426 0.0 0.0 8.5442930589E7 0.0 0.0 0.0 0.0 0.0 7.7706783289E7 0.0 0.0 0.0 0.0 0.0 2.8820751218E7 0.0 0.0 0.0 0.0 0.0 2.9717343284E7 0.0 0.0 0.0 6.753 6.75 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.79 0.78 -5664 -5663 1644 -5662 -5661 -5660 -5659 -5658 1742 -5657 -5656 -5655 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 758.472024 758.472151 6.761787231140142 6.761787231140142 6.753 6.761787231140142 6.761787231140142 6.761787231140142 6.761787231140142 6.761787231140142 6.75 6.761787231140142 6.761787231140142 6.761787231140142 1.3479865E7 2.0532614E7 1 1 1 1 1 1 1 1 1 1 1 1 758.4731284700001 758.4731284700001 0.0011044700000866214 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 758.4731284700001 9.77470000066205E-4 758.4731284700001 758.4731284700001 758.4731284700001 1000000.0 1000000.0 1.4561755171400332 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.288733856712851 1000000.0 1000000.0 1000000.0 0.0 0.0 39.11497502344742 0.0 0.0 0.0 0.0 0.0 41.28232789483457 0.0 0.0 0.0 C C 0.0 0.0 64.43982705675027 0.0 0.0 0.0 0.0 0.0 67.78707371894018 0.0 0.0 0.0 0.95 0.91 2178.9195804885426 781.3552086072659 22.3659 18.6289 0 0 14 0 0 0 0 0 14 0 0 0 -0 PE(38:4)+H PE(38:4)+H PE (38:4) (38:4) 768.5537834700001 C43 H79 O8 N1 P1 1.1400079016E7 2156045.175 6.59 10.548085257815659 1.6994614020550722 1.0 7.746710697793716 0.0 0.0 1.1400079016E7 0.0 0.0 0.0 0.0 0.0 9817537.102 0.0 0.0 0.0 0.0 0.0 2104842.064 0.0 0.0 0.0 0.0 0.0 2156045.175 0.0 0.0 0.0 6.591 6.589 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 1.0 0.87 -5675 -5674 -5673 -5672 -5671 -5670 -5669 -5668 1670 -5667 -5666 -5665 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 768.55378 768.553568 6.59 6.59 6.591 6.59 6.59 6.59 6.59 6.59 6.589 6.59 6.59 6.59 1080770.875 1 1 1 1 1 1 1 1 1 1 1 1 768.5537834700001 768.5537834700001 3.470000137895113E-6 768.5537834700001 768.5537834700001 768.5537834700001 768.5537834700001 768.5537834700001 2.1547000005739392E-4 768.5537834700001 768.5537834700001 768.5537834700001 1000000.0 1000000.0 0.004514973724061513 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2803577377298861 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.569639817571855 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.64899434244907 0.0 0.0 0.0 1.0 0.99 7.746710697793716 5.153035271685192 6.6108 7.7621 0 0 25 0 0 0 0 0 26 0 0 0 -0 PE(18:1_20:3)+Na PE(38:4)+Na PE (18:1_20:3) (18:1) (20:3) 790.5357284700001 C43 H78 O8 N1 P1 Na1 1.709831203E8 3.2620046854E7 7.402 5.810310118362797 2.2644370796724584 0.85 16.44506443026566 0.0 0.0 1.57487858329E8 0.0 0.0 0.0 0.0 0.0 1.709831203E8 0.0 0.0 0.0 0.0 0.0 3.1591886144E7 0.0 0.0 0.0 0.0 0.0 3.2620046854E7 0.0 0.0 0.0 7.404 7.378 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5686 -5685 2002 -5684 -5683 -5682 -5681 -5680 -5679 -5678 -5677 -5676 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 790.534295 790.53573 7.402 7.402 7.404 7.402 7.402 7.402 7.402 7.402 7.378 7.402 7.402 7.402 895163.5 1 1 1 1 1 1 1 1 1 1 1 1 790.5357284700001 790.5357284700001 0.0014334700000517842 790.5357284700001 790.5357284700001 790.5357284700001 790.5357284700001 790.5357284700001 1.5299998494811007E-6 790.5357284700001 790.5357284700001 790.5357284700001 1000000.0 1000000.0 1.813289328271243 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0019353962058644163 1000000.0 1000000.0 1000000.0 0.0 0.0 11.200836512827111 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 36.01555148819006 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.88 0.85 20.09726871781628 16.44506443026566 11.0383 9.7863 0 0 19 0 0 0 0 0 19 0 0 0 -0 PE(38:4e)+H PE(38:4e)+H PE (38:4e) (38:4e) 754.57451847 C43 H81 O7 N1 P1 2.2448055071E7 8223408.582 8.087535692159094 5.565961465951714 0.08606098929472975 0.98 27.76902534281307 0.0 0.0 2.0747976296E7 0.0 0.0 0.0 0.0 0.0 2.2448055071E7 0.0 0.0 0.0 0.0 0.0 8223408.582 0.0 0.0 0.0 0.0 0.0 8213406.072 0.0 0.0 0.0 8.087 8.092 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 1.0 0.91 -5707 -5706 2268 -5705 -5704 -5703 -5702 -5701 2368 -5700 -5699 -5698 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 754.573996 754.573996 8.087535692159094 8.087535692159094 8.087 8.087535692159094 8.087535692159094 8.087535692159094 8.087535692159094 8.087535692159094 8.092 8.087535692159094 8.087535692159094 8.087535692159094 8097410.0 9186794.0 1 1 1 1 1 1 1 1 1 1 1 1 754.57451847 754.57451847 5.224700000781013E-4 754.57451847 754.57451847 754.57451847 754.57451847 754.57451847 5.224700000781013E-4 754.57451847 754.57451847 754.57451847 1000000.0 1000000.0 0.6924034502748364 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6924034502748364 1000000.0 1000000.0 1000000.0 0.0 0.0 10.242162881671327 0.0 0.0 0.0 0.0 0.0 9.868043997523666 0.0 0.0 0.0 C C 0.0 0.0 47.860574213417415 0.0 0.0 0.0 0.0 0.0 46.767981030917845 0.0 0.0 0.0 0.98 0.98 29.778924797799235 27.76902534281307 7.0495 6.6655 0 0 10 0 0 0 0 0 10 0 0 0 -0 PE(38:4e)+H PE(38:4e)+H PE (38:4e) (38:4e) 754.57451847 C43 H81 O7 N1 P1 1.1211771748E7 5081759.39 8.481 9.04706687587535 14.137322340844197 0.98 7.813490125284825 0.0 0.0 9863533.404 0.0 0.0 0.0 0.0 0.0 1.1211771748E7 0.0 0.0 0.0 0.0 0.0 4158089.027 0.0 0.0 0.0 0.0 0.0 5081759.39 0.0 0.0 0.0 8.481 8.484 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5718 -5717 2457 -5716 -5715 -5714 -5713 -5712 -5711 -5710 -5709 -5708 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 754.574826 754.57452 8.481 8.481 8.481 8.481 8.481 8.481 8.481 8.481 8.484 8.481 8.481 8.481 2478239.75 1 1 1 1 1 1 1 1 1 1 1 1 754.57451847 754.57451847 3.0752999998640007E-4 754.57451847 754.57451847 754.57451847 754.57451847 754.57451847 1.5299999631679384E-6 754.57451847 754.57451847 754.57451847 1000000.0 1000000.0 0.40755418114298103 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0020276326932828536 1000000.0 1000000.0 1000000.0 0.0 0.0 8.75430392226567 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 41.687161534598424 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 6.97403646371382 7.813490125284825 10.4469 14.4069 0 0 10 0 0 0 0 0 9 0 0 0 -0 PE(38:5)+H PE(38:5)+H PE (38:5) (38:5) 766.53813347 C43 H77 O8 N1 P1 8.3650656445E7 3.2789559284E7 7.597 5.239167180516384 1.7009376268236545 0.99 3.265386E7 0.0 0.0 7.767413647E7 0.0 0.0 0.0 0.0 0.0 8.3650656445E7 0.0 0.0 0.0 0.0 0.0 3.2010183917E7 0.0 0.0 0.0 0.0 0.0 3.2789559284E7 0.0 0.0 0.0 7.597 7.595 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5729 -5728 2034 -5727 -5726 -5725 -5724 -5723 -5722 -5721 -5720 -5719 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 766.537327 766.53573 7.597 7.597 7.597 7.597 7.597 7.597 7.597 7.597 7.595 7.597 7.597 7.597 1.3524452E7 1 1 1 1 1 1 1 1 1 1 1 1 766.53813347 766.53813347 8.064700000431912E-4 766.53813347 766.53813347 766.53813347 766.53813347 766.53813347 0.00240347000010388 766.53813347 766.53813347 766.53813347 1000000.0 1000000.0 1.0520937769820085 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.1354865402765304 1000000.0 1000000.0 1000000.0 0.0 0.0 11.72589391627479 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 55.572956949169615 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 2.137527784655133 3.265386E7 4.768 10.5887 0 0 9 0 0 0 0 0 9 0 0 0 -0 PE(38:6)+H PE(38:6)+H PE (38:6) (38:6) 764.5224834700001 C43 H75 O8 N1 P1 1.85457509361E8 6.3838805491E7 7.249 2.246121949318747 2.0235479661323086 0.86 54.57945528288951 0.0 0.0 1.79658560459E8 0.0 0.0 0.0 0.0 0.0 1.85457509361E8 0.0 0.0 0.0 0.0 0.0 6.3838805491E7 0.0 0.0 0.0 0.0 0.0 6.203768351E7 0.0 0.0 0.0 7.253 7.25 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.8 0.79 -5740 -5739 -5738 -5737 -5736 -5735 -5734 -5733 1962 -5732 -5731 -5730 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 764.52248 764.523229 7.249 7.249 7.253 7.249 7.249 7.249 7.249 7.249 7.25 7.249 7.249 7.249 7319293.0 1 1 1 1 1 1 1 1 1 1 1 1 764.5224834700001 764.5224834700001 3.470000137895113E-6 764.5224834700001 764.5224834700001 764.5224834700001 764.5224834700001 764.5224834700001 7.455299999037379E-4 764.5224834700001 764.5224834700001 764.5224834700001 1000000.0 1000000.0 0.0045387810207301454 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9751577174289767 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 12.380830754625995 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 57.85434932068222 0.0 0.0 0.0 0.97 0.86 10.784398268547383 54.57945528288951 3.8549 3.5202 0 0 9 0 0 0 0 0 14 0 0 0 -0 PE(18:3_20:4)+H PE(38:7)+H PE (18:3_20:4) (18:3) (20:4) 762.5068334700001 C43 H73 O8 N1 P1 3.7772586754E7 1.3452349429E7 7.063 0.6564548198994643 2.3066973171578837 0.99 66.6060334335004 0.0 0.0 3.7423538631E7 0.0 0.0 0.0 0.0 0.0 3.7772586754E7 0.0 0.0 0.0 0.0 0.0 1.3452349429E7 0.0 0.0 0.0 0.0 0.0 1.3020554834E7 0.0 0.0 0.0 7.065 7.063 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5751 -5750 -5749 -5748 -5747 -5746 -5745 -5744 1885 -5743 -5742 -5741 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.50443 762.505834 7.063 7.063 7.065 7.063 7.063 7.063 7.063 7.063 7.063 7.063 7.063 7.063 7636083.0 1 1 1 1 1 1 1 1 1 1 1 1 762.5068334700001 762.5068334700001 0.00240347000010388 762.5068334700001 762.5068334700001 762.5068334700001 762.5068334700001 762.5068334700001 9.994700000106604E-4 762.5068334700001 762.5068334700001 762.5068334700001 1000000.0 1000000.0 3.152063554848708 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.3107685808693588 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 12.972717965740866 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 41.847477308841505 0.0 0.0 0.0 0.99 0.99 72.70091569821852 66.6060334335004 4.2201 4.3863 0 0 11 0 0 0 0 0 13 0 0 0 -0 PE(18:3_20:5)+H PE(38:8)+H PE (18:3_20:5) (18:3) (20:5) 760.4911834700001 C43 H71 O8 N1 P1 2.1477827155E7 7274442.417 6.676013945117956 2.2996760941802927 3.3129532849742502 1.0 7971997.5 0.0 0.0 2.0790494969E7 0.0 0.0 0.0 0.0 0.0 2.1477827155E7 0.0 0.0 0.0 0.0 0.0 6941419.957 0.0 0.0 0.0 0.0 0.0 7274442.417 0.0 0.0 0.0 6.676 6.676 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.97 0.98 -5761 -5760 1608 -5759 -5758 -5757 -5756 -5755 1708 -5754 -5753 -5752 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 760.490845 760.490757 6.676013945117956 6.676013945117956 6.676 6.676013945117956 6.676013945117956 6.676013945117956 6.676013945117956 6.676013945117956 6.676 6.676013945117956 6.676013945117956 6.676013945117956 4813508.5 3856088.5 1 1 1 1 1 1 1 1 1 1 1 1 760.4911834700001 760.4911834700001 3.384700000879093E-4 760.4911834700001 760.4911834700001 760.4911834700001 760.4911834700001 760.4911834700001 4.264700000931043E-4 760.4911834700001 760.4911834700001 760.4911834700001 1000000.0 1000000.0 0.4450676187244204 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5607823067023467 1000000.0 1000000.0 1000000.0 0.0 0.0 18.050859718674225 0.0 0.0 0.0 0.0 0.0 13.078782992713831 0.0 0.0 0.0 B B 0.0 0.0 43.91936671210275 0.0 0.0 0.0 0.0 0.0 42.32615855247195 0.0 0.0 0.0 1.0 1.0 81.77436976617942 7971997.5 12.9766 10.7016 0 0 10 0 0 0 0 0 11 0 0 0 -0 PE(39:2)+Na PE(39:2)+Na PE (39:2) (39:2) 808.5826784700001 C44 H84 O8 N1 P1 Na1 2.7860990407E8 3.9610138541E7 8.345 8.604321211653794 0.11568938941276734 0.98 334.9164231698338 0.0 0.0 2.46652053279E8 0.0 0.0 0.0 0.0 0.0 2.7860990407E8 0.0 0.0 0.0 0.0 0.0 3.9545385561E7 0.0 0.0 0.0 0.0 0.0 3.9610138541E7 0.0 0.0 0.0 8.348 8.355 0.0 0.0 0.05 0.0 0.0 0.0 0.0 0.0 0.055 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.055 0.0 0.0 0.0 0.84 0.85 -5772 -5771 2466 -5770 -5769 -5768 -5767 -5766 -5765 -5764 -5763 -5762 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.581028 808.58268 8.345 8.345 8.348 8.345 8.345 8.345 8.345 8.345 8.355 8.345 8.345 8.345 1482847.0 1 1 1 1 1 1 1 1 1 1 1 1 808.5826784700001 808.5826784700001 0.0016504700001860328 808.5826784700001 808.5826784700001 808.5826784700001 808.5826784700001 808.5826784700001 1.5299998494811007E-6 808.5826784700001 808.5826784700001 808.5826784700001 1000000.0 1000000.0 2.041188915039649 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0018921996355105775 1000000.0 1000000.0 1000000.0 0.0 0.0 5.147224554349593 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 0.0 0.0 46.79295049408721 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.98 1843.4415628414042 334.9164231698338 5.6132 6.0593 0 0 31 0 0 0 0 0 30 0 0 0 -0 PE(43:4)+Na PE(43:4)+Na PE (43:4) (43:4) 860.6139784700001 C48 H88 O8 N1 P1 Na1 790459.068 309497.031 7.434 1.29762702305321 10.093828152044932 0.97 40.86639226992013 0.0 776085.072 0.0 0.0 0.0 0.0 0.0 790459.068 0.0 0.0 0.0 0.0 0.0 309497.031 0.0 0.0 0.0 0.0 0.0 268260.11 0.0 0.0 0.0 0.0 7.435 7.431 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.91 0.95 -5794 278 -5793 -5792 -5791 -5790 -5789 -5788 -5787 -5786 -5785 -5784 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 860.609911 860.61398 7.434 7.435 7.434 7.434 7.434 7.434 7.434 7.431 7.434 7.434 7.434 7.434 186681.03125 1 1 1 1 1 1 1 1 1 1 1 1 860.6139784700001 0.004067470000109097 860.6139784700001 860.6139784700001 860.6139784700001 860.6139784700001 860.6139784700001 1.5299998494811007E-6 860.6139784700001 860.6139784700001 860.6139784700001 860.6139784700001 1000000.0 4.726242080497283 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017778003701510114 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.015727237323465 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 D 0.0 43.615019454986644 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.97 350776.84 40.86639226992013 12.0238 9.7205 0 9 0 0 0 0 0 14 0 0 0 0 -0 PE(51:2)+H PE(51:2)+H PE (51:2) (51:2) 954.7885334700001 C56 H109 O8 N1 P1 2.9362917039E7 6965311.651 9.532486106956725 0.6571953301211432 1.359166661021762 0.98 12.887840521682731 0.0 2.9362917039E7 0.0 0.0 0.0 0.0 0.0 2.9091276151E7 0.0 0.0 0.0 0.0 0.0 6965311.651 0.0 0.0 0.0 0.0 0.0 6832702.256 0.0 0.0 0.0 0.0 9.531 9.533 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5836 802 -5835 -5834 -5833 -5832 -5831 829 -5830 -5829 -5828 -5827 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 954.78766 954.788172 9.532486106956725 9.531 9.532486106956725 9.532486106956725 9.532486106956725 9.532486106956725 9.532486106956725 9.533 9.532486106956725 9.532486106956725 9.532486106956725 9.532486106956725 1264400.875 736052.5625 1 1 1 1 1 1 1 1 1 1 1 1 954.7885334700001 8.734700001014062E-4 954.7885334700001 954.7885334700001 954.7885334700001 954.7885334700001 954.7885334700001 3.6147000002983987E-4 954.7885334700001 954.7885334700001 954.7885334700001 954.7885334700001 1000000.0 0.9148308441943088 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3785864485784563 1000000.0 1000000.0 1000000.0 1000000.0 0.0 10.739548447502882 0.0 0.0 0.0 0.0 0.0 8.829426609123605 0.0 0.0 0.0 0.0 C C 0.0 50.42041524649241 0.0 0.0 0.0 0.0 0.0 41.64823872228115 0.0 0.0 0.0 0.0 0.98 0.97 12.887840521682731 59.213870113078166 44.9173 18.9183 0 15 0 0 0 0 0 15 0 0 0 0 -0 PE(51:3)+H PE(51:3)+H PE (51:3) (51:3) 952.7728834700001 C56 H107 O8 N1 P1 1.038724486E7 2912064.49 9.576733854070444 3.8798688247029487 9.444020942582615 0.99 36.460509243465914 0.0 1.038724486E7 0.0 0.0 0.0 0.0 0.0 9832519.358 0.0 0.0 0.0 0.0 0.0 2547479.871 0.0 0.0 0.0 0.0 0.0 2912064.49 0.0 0.0 0.0 0.0 9.581 9.57 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5846 832 -5845 -5844 -5843 -5842 -5841 866 -5840 -5839 -5838 -5837 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 952.773987 952.774247 9.576733854070444 9.581 9.576733854070444 9.576733854070444 9.576733854070444 9.576733854070444 9.576733854070444 9.57 9.576733854070444 9.576733854070444 9.576733854070444 9.576733854070444 2508193.25 1972329.125 1 1 1 1 1 1 1 1 1 1 1 1 952.7728834700001 0.0011035299999093695 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 0.0013635299998213668 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 1000000.0 1.1582298563014428 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.431117555377299 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.594152655885088 0.0 0.0 0.0 0.0 0.0 5.816816707100511 0.0 0.0 0.0 0.0 D D 0.0 50.397771674640424 0.0 0.0 0.0 0.0 0.0 51.93586345625456 0.0 0.0 0.0 0.0 0.99 0.97 36.460509243465914 66.60891236948862 9.7231 11.5887 0 15 0 0 0 0 0 15 0 0 0 0 -0 PE(51:3)+H PE(51:3)+H PE (51:3) (51:3) 952.7728834700001 C56 H107 O8 N1 P1 2.243559726E7 5412760.864 9.772 3.5548268337489404 4.894867883000336 1.0 24.235906950863303 0.0 2.243559726E7 0.0 0.0 0.0 0.0 0.0 2.133535222E7 0.0 0.0 0.0 0.0 0.0 5050603.496 0.0 0.0 0.0 0.0 0.0 5412760.864 0.0 0.0 0.0 0.0 9.772 9.77 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 1.0 -5856 889 -5855 -5854 -5853 -5852 -5851 929 -5850 -5849 -5848 -5847 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 952.772512 952.772371 9.772 9.772 9.772 9.772 9.772 9.772 9.772 9.77 9.772 9.772 9.772 9.772 2721066.5 3045350.25 1 1 1 1 1 1 1 1 1 1 1 1 952.7728834700001 3.7147000011827913E-4 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 5.124700001033489E-4 952.7728834700001 952.7728834700001 952.7728834700001 952.7728834700001 1000000.0 0.3898830524703693 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5378721508497727 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.184880901167526 0.0 0.0 0.0 0.0 0.0 11.258848429135561 0.0 0.0 0.0 0.0 D C 0.0 45.88390178024359 0.0 0.0 0.0 0.0 0.0 52.12429828303501 0.0 0.0 0.0 0.0 1.0 0.98 24.235906950863303 44.44428034388271 10.6787 11.2499 0 15 0 0 0 0 0 13 0 0 0 0 -0 PG(19:0_14:4)+NH4 PG(33:4)+NH4 PG (19:0_14:4) (19:0) (14:4) 746.49666347 C39 H73 O10 N1 P1 1.6197749779E7 5199038.606 5.71 2.556357721238263 6.452484510316099 1.0 59.09691884523958 0.0 0.0 1.6197749779E7 0.0 0.0 0.0 0.0 0.0 1.5622560167E7 0.0 0.0 0.0 0.0 0.0 4745317.841 0.0 0.0 0.0 0.0 0.0 5199038.606 0.0 0.0 0.0 5.709 5.713 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.96 0.94 -5867 -5866 1222 -5865 -5864 -5863 -5862 -5861 -5860 -5859 -5858 -5857 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 746.496496 746.49666 5.71 5.71 5.709 5.71 5.71 5.71 5.71 5.71 5.713 5.71 5.71 5.71 3830488.0 1 1 1 1 1 1 1 1 1 1 1 1 746.49666347 746.49666347 1.6747000006489543E-4 746.49666347 746.49666347 746.49666347 746.49666347 746.49666347 3.470000024208275E-6 746.49666347 746.49666347 746.49666347 1000000.0 1000000.0 0.22434125731578122 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004648379817370377 1000000.0 1000000.0 1000000.0 0.0 0.0 5.3728010119134755 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 25.830774095737862 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 59.09691884523958 164.66708272690258 24.7778 23.7528 0 0 13 0 0 0 0 0 13 0 0 0 -0 PG(16:0_18:3)+NH4 PG(34:3)+NH4 PG (16:0_18:3) (16:0) (18:3) 762.5279634699999 C40 H77 O10 N1 P1 1.2050694227E7 4829400.613 7.257499956665767 0.8281361292657297 0.05568119967164943 0.99 16.365940561462132 0.0 0.0 1.2050694227E7 0.0 0.0 0.0 0.0 0.0 1.1910382791E7 0.0 0.0 0.0 0.0 0.0 4829400.613 0.0 0.0 0.0 0.0 0.0 4825599.193 0.0 0.0 0.0 7.262 7.253 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5877 -5876 1878 -5875 -5874 -5873 -5872 -5871 1969 -5870 -5869 -5868 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.5271 762.527649 7.257499956665767 7.257499956665767 7.262 7.257499956665767 7.257499956665767 7.257499956665767 7.257499956665767 7.257499956665767 7.253 7.257499956665767 7.257499956665767 7.257499956665767 3617906.5 4156612.75 1 1 1 1 1 1 1 1 1 1 1 1 762.5279634699999 762.5279634699999 8.634699998992801E-4 762.5279634699999 762.5279634699999 762.5279634699999 762.5279634699999 762.5279634699999 3.144699999211298E-4 762.5279634699999 762.5279634699999 762.5279634699999 1000000.0 1000000.0 1.132378143838723 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.41240454774941765 1000000.0 1000000.0 1000000.0 0.0 0.0 6.296204056152144 0.0 0.0 0.0 0.0 0.0 15.125376912564246 0.0 0.0 0.0 C A 0.0 0.0 54.74960048827951 0.0 0.0 0.0 0.0 0.0 48.32388789956628 0.0 0.0 0.0 0.99 0.94 16.365940561462132 16.787553514323992 5.6653 6.3218 0 0 10 0 0 0 0 0 10 0 0 0 -0 PG(18:3_18:3)+H PG(36:6)+H PG (18:3_18:3) (18:3) (18:3) 767.4857644700002 C42 H72 O10 N0 P1 3062027.588 1308482.357 6.531 0.5676357372877802 3.710231991608475 0.99 24.75955870498377 0.0 0.0 3062027.588 0.0 0.0 0.0 0.0 0.0 3037545.179 0.0 0.0 0.0 0.0 0.0 1241580.683 0.0 0.0 0.0 0.0 0.0 1308482.357 0.0 0.0 0.0 6.53 6.533 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5888 -5887 1565 -5886 -5885 -5884 -5883 -5882 -5881 -5880 -5879 -5878 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 767.485733 767.48576 6.531 6.531 6.53 6.531 6.531 6.531 6.531 6.531 6.533 6.531 6.531 6.531 1145760.875 1 1 1 1 1 1 1 1 1 1 1 1 767.4857644700002 767.4857644700002 3.1470000180888746E-5 767.4857644700002 767.4857644700002 767.4857644700002 767.4857644700002 767.4857644700002 4.4700001353703556E-6 767.4857644700002 767.4857644700002 767.4857644700002 1000000.0 1000000.0 0.04100401810399815 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005824212437942985 1000000.0 1000000.0 1000000.0 0.0 0.0 5.032830043344648 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 24.080526523180133 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 24.75955870498377 38.54134401117735 11.3969 10.5581 0 0 9 0 0 0 0 0 9 0 0 0 -0 PI(16:0_16:0)+Na PI(32:0)+Na PI (16:0_16:0) (16:0) (16:0) 833.5150544700001 C41 H79 O13 N0 P1 Na1 3.356888163E7 1.1537898029E7 7.105505343856591 1.203414793107942 2.3038188966622077 1.0 1.2449573E7 0.0 0.0 3.356888163E7 0.0 0.0 0.0 0.0 0.0 3.3002398144E7 0.0 0.0 0.0 0.0 0.0 1.1537898029E7 0.0 0.0 0.0 0.0 0.0 1.1168008377E7 0.0 0.0 0.0 7.108 7.103 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.97 0.96 -5898 -5897 1805 -5896 -5895 -5894 -5893 -5892 1904 -5891 -5890 -5889 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 833.516241 833.517862 7.105505343856591 7.105505343856591 7.108 7.105505343856591 7.105505343856591 7.105505343856591 7.105505343856591 7.105505343856591 7.103 7.105505343856591 7.105505343856591 7.105505343856591 8444687.0 8098677.5 1 1 1 1 1 1 1 1 1 1 1 1 833.5150544700001 833.5150544700001 0.0011865299999271883 833.5150544700001 833.5150544700001 833.5150544700001 833.5150544700001 833.5150544700001 0.002807529999927283 833.5150544700001 833.5150544700001 833.5150544700001 1000000.0 1000000.0 1.4235255782892329 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.3683014900222554 1000000.0 1000000.0 1000000.0 0.0 0.0 18.081132783103275 0.0 0.0 0.0 0.0 0.0 18.405477936056794 0.0 0.0 0.0 A A 0.0 0.0 57.400421533661195 0.0 0.0 0.0 0.0 0.0 58.99191646172049 0.0 0.0 0.0 1.0 0.97 1.2449573E7 1.2585421E7 11.5831 8.9746 0 0 10 0 0 0 0 0 11 0 0 0 -0 PI(32:3)+NH4 PI(32:3)+NH4 PI (32:3) (32:3) 822.5127084700001 C41 H77 O13 N1 P1 6157367.708 2075916.761 6.649652888285892 4.194898183677431 1.7999304926608544 0.99 2201289.25 0.0 0.0 5802606.068 0.0 0.0 0.0 0.0 0.0 6157367.708 0.0 0.0 0.0 0.0 0.0 2075916.761 0.0 0.0 0.0 0.0 0.0 2023738.681 0.0 0.0 0.0 6.656 6.654 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.95 0.95 -5909 -5908 -5907 -5906 -5905 -5904 -5903 -5902 1706 -5901 -5900 -5899 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 822.51271 822.512184 6.649652888285892 6.649652888285892 6.656 6.649652888285892 6.649652888285892 6.649652888285892 6.649652888285892 6.649652888285892 6.654 6.649652888285892 6.649652888285892 6.649652888285892 2104092.25 1 1 1 1 1 1 1 1 1 1 1 1 822.5127084700001 822.5127084700001 1.5299998494811007E-6 822.5127084700001 822.5127084700001 822.5127084700001 822.5127084700001 822.5127084700001 5.244700000730518E-4 822.5127084700001 822.5127084700001 822.5127084700001 1000000.0 1000000.0 0.001860153446537179 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6376436432801708 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.951062967003189 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 54.59690795415769 0.0 0.0 0.0 0.99 0.99 267.9637065422637 2201289.25 17.5626 19.5887 0 0 9 0 0 0 0 0 9 0 0 0 -0 PI(32:3)+Na PI(32:3)+Na PI (32:3) (32:3) 827.4681044700002 C41 H73 O13 N0 P1 Na1 7589358.187 2940169.542 6.649652888285892 3.267083814872338 12.256171675955974 1.0 2896996.75 0.0 0.0 7246620.795 0.0 0.0 0.0 0.0 0.0 7589358.187 0.0 0.0 0.0 0.0 0.0 2471197.622 0.0 0.0 0.0 0.0 0.0 2940169.542 0.0 0.0 0.0 6.65 6.651 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 1.0 -5920 -5919 -5918 -5917 -5916 -5915 -5914 -5913 1704 -5912 -5911 -5910 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 827.4681 827.468084 6.649652888285892 6.649652888285892 6.65 6.649652888285892 6.649652888285892 6.649652888285892 6.649652888285892 6.649652888285892 6.651 6.649652888285892 6.649652888285892 6.649652888285892 2690795.75 1 1 1 1 1 1 1 1 1 1 1 1 827.4681044700002 827.4681044700002 4.4700001353703556E-6 827.4681044700002 827.4681044700002 827.4681044700002 827.4681044700002 827.4681044700002 2.0470000208661077E-5 827.4681044700002 827.4681044700002 827.4681044700002 1000000.0 1000000.0 0.005402021070326845 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.024738113889927242 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.883601601902938 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 28.423196144458636 0.0 0.0 0.0 0.99 1.0 2762996.5 2896996.75 21.0008 19.8715 0 0 9 0 0 0 0 0 9 0 0 0 -0 PI(11:0_23:0)+Na PI(34:0)+Na PI (11:0_23:0) (11:0) (23:0) 861.5463544700001 C43 H83 O13 N0 P1 Na1 8118302.493 3196168.781 7.564 1.9543594799310628 0.2657975362584613 0.95 3801973.75 0.0 8118302.493 0.0 0.0 0.0 0.0 0.0 7896980.753 0.0 0.0 0.0 0.0 0.0 3184177.097 0.0 0.0 0.0 0.0 0.0 3196168.781 0.0 0.0 0.0 0.0 7.563 7.562 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.96 0.94 -5931 289 -5930 -5929 -5928 -5927 -5926 -5925 -5924 -5923 -5922 -5921 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 861.550542 861.54635 7.564 7.563 7.564 7.564 7.564 7.564 7.564 7.562 7.564 7.564 7.564 7.564 303253.03125 1 1 1 1 1 1 1 1 1 1 1 1 861.5463544700001 0.004187529999853723 861.5463544700001 861.5463544700001 861.5463544700001 861.5463544700001 861.5463544700001 4.4700001353703556E-6 861.5463544700001 861.5463544700001 861.5463544700001 861.5463544700001 1000000.0 4.860481363686783 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005188345481561672 1000000.0 1000000.0 1000000.0 1000000.0 0.0 10.551876699037223 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 49.77300329734538 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.98 3801973.75 3505881.75 7.9658 7.4478 0 15 0 0 0 0 0 15 0 0 0 0 -0 PI(16:0_18:2)+NH4 PI(34:2)+NH4 PI (16:0_18:2) (16:0) (18:2) 852.55965847 C43 H83 O13 N1 P1 1.6691253685E7 6394206.057 7.449980456045568 70.48350981922569 72.33645101436673 0.99 284.5904615520341 0.0 3959129.049 1.4930651959E7 0.0 0.0 0.0 0.0 3772207.51 1.6691253685E7 0.0 0.0 0.0 0.0 1534075.14 6066173.148 0.0 0.0 0.0 0.0 1337085.637 6394206.057 0.0 0.0 0.0 7.449 7.456 7.446 7.448 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 1.0 1.0 1.0 0.89 -5939 274 1971 -5938 -5937 -5936 -5935 282 2072 -5934 -5933 -5932 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 852.560356 852.560862 852.560413 852.558259 7.449980456045568 7.449 7.456 7.449980456045568 7.449980456045568 7.449980456045568 7.449980456045568 7.446 7.448 7.449980456045568 7.449980456045568 7.449980456045568 692733.5625 4996594.5 370923.40625 6257655.0 1 1 1 1 1 1 1 1 1 1 1 1 852.55965847 6.975299999112394E-4 0.0012035299999979543 852.55965847 852.55965847 852.55965847 852.55965847 7.545299999947019E-4 0.001399470000023939 852.55965847 852.55965847 852.55965847 1000000.0 0.8181597533749413 1.4116666066018233 1000000.0 1000000.0 1000000.0 1000000.0 0.8850172448327878 1.6414921655282422 1000000.0 1000000.0 1000000.0 0.0 7.135354589186066 6.461320467891617 0.0 0.0 0.0 0.0 13.118608470995792 5.530077578583993 0.0 0.0 0.0 C C B C 0.0 62.590829729702335 60.38617259711791 0.0 0.0 0.0 0.0 60.454416917031295 52.1705431941886 0.0 0.0 0.0 1.0 0.98 0.98 0.99 67.64838688313698 5.383107841527756 53.38961542345112 284.5904615520341 11.7745 10.5666 13.1278 11.6833 0 18 13 0 0 0 0 19 12 0 0 0 -0 PI(16:0_18:2)+H PI(34:2)+H PI (16:0_18:2) (16:0) (18:2) 835.5331094700001 C43 H80 O13 N0 P1 1.5447787979E7 7227241.159 7.449980456045568 8.317781311967034 25.87046078681204 1.0 6.385286278593677 0.0 0.0 1.3731585732E7 0.0 0.0 0.0 0.0 0.0 1.5447787979E7 0.0 0.0 0.0 0.0 0.0 4991960.769 0.0 0.0 0.0 0.0 0.0 7227241.159 0.0 0.0 0.0 7.448 7.448 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -5950 -5949 1970 -5948 -5947 -5946 -5945 -5944 -5943 -5942 -5941 -5940 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 835.532224 835.53311 7.449980456045568 7.449980456045568 7.448 7.449980456045568 7.449980456045568 7.449980456045568 7.449980456045568 7.449980456045568 7.448 7.449980456045568 7.449980456045568 7.449980456045568 5245153.0 1 1 1 1 1 1 1 1 1 1 1 1 835.5331094700001 835.5331094700001 8.854700000711091E-4 835.5331094700001 835.5331094700001 835.5331094700001 835.5331094700001 835.5331094700001 5.29999852005858E-7 835.5331094700001 835.5331094700001 835.5331094700001 1000000.0 1000000.0 1.0597665012135609 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 6.343253738227686E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 10.023047026395325 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 47.27852370941191 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 7.718580001954258 6.385286278593677 8.754 6.8671 0 0 10 0 0 0 0 0 11 0 0 0 -0 PI(16:0_18:3)+NH4 PI(34:3)+NH4 PI (16:0_18:3) (16:0) (18:3) 850.54400847 C43 H81 O13 N1 P1 4.0148167163E7 1.3672639115E7 7.106141785835703 90.69758615458349 87.64590157421618 0.97 82.61847645392328 0.0 4564589.858 3.8767323356E7 0.0 0.0 0.0 0.0 4934134.562 4.0148167163E7 0.0 0.0 0.0 0.0 1802489.936 1.3575570531E7 0.0 0.0 0.0 0.0 1930773.699 1.3672639115E7 0.0 0.0 0.0 7.111 7.109 7.107 7.103 0.0 0.02 0.023 0.0 0.0 0.0 0.0 0.017 0.02 0.0 0.0 0.0 0.0 0.02 0.021 0.0 0.0 0.0 0.0 0.023 0.026 0.0 0.0 0.0 0.93 0.94 0.91 0.93 -5958 219 1804 -5957 -5956 -5955 -5954 228 1902 -5953 -5952 -5951 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 850.545389 850.542939 850.544684 850.54122 7.106141785835703 7.111 7.109 7.106141785835703 7.106141785835703 7.106141785835703 7.106141785835703 7.107 7.103 7.106141785835703 7.106141785835703 7.106141785835703 661307.6875 5497902.5 328962.84375 3663323.25 1 1 1 1 1 1 1 1 1 1 1 1 850.54400847 0.0013805300000058196 0.0010694699999476143 850.54400847 850.54400847 850.54400847 850.54400847 6.755299999667841E-4 0.002788470000041343 850.54400847 850.54400847 850.54400847 1000000.0 1.6231141319650046 1.2573952544459506 1000000.0 1000000.0 1000000.0 1000000.0 0.7942328594871422 3.278454697549841 1000000.0 1000000.0 1000000.0 0.0 13.169012215955652 5.870168763401698 0.0 0.0 0.0 0.0 7.475853661032878 6.564308404209727 0.0 0.0 0.0 B C C C 0.0 61.537440261475005 53.36517057637907 0.0 0.0 0.0 0.0 65.57766369327086 58.60989646615828 0.0 0.0 0.0 1.0 0.98 0.98 0.97 325.9913608370515 65.06584071370419 4514.982763779343 82.61847645392328 17.642 25.383 23.5996 11.9197 0 12 10 0 0 0 0 11 10 0 0 0 -0 PI(34:3)+Na PI(34:3)+Na PI (16:0_18:3) (16:0) (18:3) 855.4994044700001 C43 H77 O13 N0 P1 Na1 2.0869976579E7 8181120.59 7.106141785835703 33.51580253165143 30.333964232316728 1.0 15.320522933696187 0.0 1.1170607099E7 2.0869976579E7 0.0 0.0 0.0 0.0 1.1533031427E7 2.0374700218E7 0.0 0.0 0.0 0.0 4470306.639 7758346.591 0.0 0.0 0.0 0.0 4878173.011 8181120.59 0.0 0.0 0.0 7.108 7.104 7.102 7.101 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -5967 -5966 1807 -5965 -5964 -5963 -5962 227 1905 -5961 -5960 -5959 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 855.4994 855.497135 855.499964 855.497749 7.106141785835703 7.108 7.104 7.106141785835703 7.106141785835703 7.106141785835703 7.106141785835703 7.102 7.101 7.106141785835703 7.106141785835703 7.106141785835703 6705532.5 907064.625 4906122.5 1 1 1 1 1 1 1 1 1 1 1 1 855.4994044700001 4.470000021683518E-6 0.002269470000101137 855.4994044700001 855.4994044700001 855.4994044700001 855.4994044700001 5.595299999185954E-4 0.0016554700000597222 855.4994044700001 855.4994044700001 855.4994044700001 1000000.0 0.005225018273920105 2.6528013792214407 1000000.0 1000000.0 1000000.0 1000000.0 0.6540390291273622 1.9350919374225874 1000000.0 1000000.0 1000000.0 0.0 0.0 6.047167942582965 0.0 0.0 0.0 0.0 6.268095863220001 6.190616840014977 0.0 0.0 0.0 C C C 0.0 0.0 29.21337170329935 0.0 0.0 0.0 0.0 29.566489920849058 29.47912780959513 0.0 0.0 0.0 0.99 1.0 0.99 0.99 11311.138724373575 15.320522933696187 98.90451118897988 23.086604284071797 26.8165 15.4455 29.4656 13.8981 0 9 9 0 0 0 0 10 9 0 0 0 -0 PI(34:4)+NH4 PI(34:4)+NH4 PI (34:4) (34:4) 848.5283584700001 C43 H79 O13 N1 P1 9086229.302 2954331.319 6.710548074634107 8.772886005262912 22.524475322387293 0.97 18.945243725357805 0.0 0.0 8024771.117 0.0 0.0 0.0 0.0 0.0 9086229.302 0.0 0.0 0.0 0.0 0.0 2142541.69 0.0 0.0 0.0 0.0 0.0 2954331.319 0.0 0.0 0.0 6.709 6.708 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.81 1.0 -5977 -5976 1630 -5975 -5974 -5973 -5972 -5971 1730 -5970 -5969 -5968 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 848.528094 848.527792 6.710548074634107 6.710548074634107 6.709 6.710548074634107 6.710548074634107 6.710548074634107 6.710548074634107 6.710548074634107 6.708 6.710548074634107 6.710548074634107 6.710548074634107 2205720.5 2954551.25 1 1 1 1 1 1 1 1 1 1 1 1 848.5283584700001 848.5283584700001 2.6447000004736765E-4 848.5283584700001 848.5283584700001 848.5283584700001 848.5283584700001 848.5283584700001 5.664700000806988E-4 848.5283584700001 848.5283584700001 848.5283584700001 1000000.0 1000000.0 0.31168080289530836 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6675911234152659 1000000.0 1000000.0 1000000.0 0.0 0.0 6.0575342541558514 0.0 0.0 0.0 0.0 0.0 5.852399227031101 0.0 0.0 0.0 C C 0.0 0.0 57.14654956750803 0.0 0.0 0.0 0.0 0.0 54.69531987879533 0.0 0.0 0.0 0.95 0.97 2404396.25 18.945243725357805 7.5224 9.7978 0 0 15 0 0 0 0 0 15 0 0 0 -0 PI(34:4)+Na PI(34:4)+Na PI (34:4) (34:4) 853.4837544700001 C43 H75 O13 N0 P1 Na1 7679940.901 2258231.77 6.710548074634107 46.99298050744667 42.65786595639352 0.95 2242667.5 0.0 2964073.532 7679940.901 0.0 0.0 0.0 0.0 3126818.078 6453692.812 0.0 0.0 0.0 0.0 911669.906 2258231.77 0.0 0.0 0.0 0.0 1022973.142 1668653.704 0.0 0.0 0.0 6.713 6.71 6.708 6.707 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.94 1.0 1.0 0.88 -5987 162 -5986 -5985 -5984 -5983 -5982 169 -5981 -5980 -5979 -5978 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 853.484393 853.48375 853.484602 853.48375 6.710548074634107 6.713 6.71 6.710548074634107 6.710548074634107 6.710548074634107 6.710548074634107 6.708 6.707 6.710548074634107 6.710548074634107 6.710548074634107 467628.71875 339089.0 1 1 1 1 1 1 1 1 1 1 1 1 853.4837544700001 6.385299998328264E-4 4.4700001353703556E-6 853.4837544700001 853.4837544700001 853.4837544700001 853.4837544700001 8.475299998735863E-4 4.4700001353703556E-6 853.4837544700001 853.4837544700001 853.4837544700001 1000000.0 0.7481454643847831 0.005237358194528442 1000000.0 1000000.0 1000000.0 1000000.0 0.9930241734945372 0.005237358194528442 1000000.0 1000000.0 1000000.0 0.0 5.382281278170479 0.0 0.0 0.0 0.0 0.0 5.027408907763956 0.0 0.0 0.0 0.0 C C 0.0 25.508442076637344 0.0 0.0 0.0 0.0 0.0 23.82658250125098 0.0 0.0 0.0 0.0 0.96 0.95 0.97 0.93 353.32473688305043 2242667.5 569.6079914216377 7.290188009525716 6.7664 5.0558 7.531 4.0348 0 10 15 0 0 0 0 9 15 0 0 0 -0 PI(35:3)+NH4 PI(35:3)+NH4 PI (35:3) (35:3) 864.55965847 C44 H83 O13 N1 P1 1352693.15 586428.91 7.3434578215924455 9.520418508941184 11.486290987548562 0.99 74.16280041892682 0.0 1352693.15 0.0 0.0 0.0 0.0 0.0 1182055.102 0.0 0.0 0.0 0.0 0.0 586428.91 0.0 0.0 0.0 0.0 0.0 498324.839 0.0 0.0 0.0 0.0 7.341 7.345 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -5997 253 -5996 -5995 -5994 -5993 -5992 263 -5991 -5990 -5989 -5988 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 864.560279 864.560189 7.3434578215924455 7.341 7.3434578215924455 7.3434578215924455 7.3434578215924455 7.3434578215924455 7.3434578215924455 7.345 7.3434578215924455 7.3434578215924455 7.3434578215924455 7.3434578215924455 351371.625 279666.59375 1 1 1 1 1 1 1 1 1 1 1 1 864.55965847 6.205299999919589E-4 864.55965847 864.55965847 864.55965847 864.55965847 864.55965847 5.305299999918134E-4 864.55965847 864.55965847 864.55965847 864.55965847 1000000.0 0.7177410996600313 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6136418635709714 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.500153810967947 0.0 0.0 0.0 0.0 0.0 5.599399993257923 0.0 0.0 0.0 0.0 C C 0.0 60.18660936081432 0.0 0.0 0.0 0.0 0.0 51.84629623386966 0.0 0.0 0.0 0.0 0.99 0.99 74.16280041892682 476689.78 10.0177 8.0567 0 11 0 0 0 0 0 10 0 0 0 0 -0 PI(18:1_18:1)+Na PI(36:2)+Na PI (18:1_18:1) (18:1) (18:1) 885.5463544700001 C45 H83 O13 N0 P1 Na1 3031922.3 1233426.334 7.407 1.1651068574726773 2.4155574970254987 0.97 232.38430874540572 0.0 3031922.3 0.0 0.0 0.0 0.0 0.0 2982373.228 0.0 0.0 0.0 0.0 0.0 1191998.69 0.0 0.0 0.0 0.0 0.0 1233426.334 0.0 0.0 0.0 0.0 7.414 7.407 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6007 264 -6006 -6005 -6004 -6003 -6002 275 -6001 -6000 -5999 -5998 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 885.549314 885.549585 7.407 7.414 7.407 7.407 7.407 7.407 7.407 7.407 7.407 7.407 7.407 7.407 436238.28125 357937.0 1 1 1 1 1 1 1 1 1 1 1 1 885.5463544700001 0.0029595299998845803 885.5463544700001 885.5463544700001 885.5463544700001 885.5463544700001 885.5463544700001 0.003230529999882492 885.5463544700001 885.5463544700001 885.5463544700001 885.5463544700001 1000000.0 3.342038488381402 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.6480642527357765 1000000.0 1000000.0 1000000.0 1000000.0 0.0 13.763925024486598 0.0 0.0 0.0 0.0 0.0 11.320426734703767 0.0 0.0 0.0 0.0 A A 0.0 44.5434466811864 0.0 0.0 0.0 0.0 0.0 36.874354184702824 0.0 0.0 0.0 0.0 0.97 0.97 232.38430874540572 687.4425820070121 8.198 7.4344 0 9 0 0 0 0 0 8 0 0 0 0 -0 PI(36:2)+NH4 PI(36:2)+NH4 PI (36:2) (36:2) 880.59095847 C45 H87 O13 N1 P1 5047886.103 1666282.216 7.855 0.7621841222030642 6.689237802925617 0.9 73.87691083331325 0.0 4993767.059 0.0 0.0 0.0 0.0 0.0 5047886.103 0.0 0.0 0.0 0.0 0.0 1515770.93 0.0 0.0 0.0 0.0 0.0 1666282.216 0.0 0.0 0.0 0.0 7.856 7.858 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6018 337 -6017 -6016 -6015 -6014 -6013 -6012 -6011 -6010 -6009 -6008 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 880.591016 880.59096 7.855 7.856 7.855 7.855 7.855 7.855 7.855 7.858 7.855 7.855 7.855 7.855 610646.5625 1 1 1 1 1 1 1 1 1 1 1 1 880.59095847 5.752999993546837E-5 880.59095847 880.59095847 880.59095847 880.59095847 880.59095847 1.5299999631679384E-6 880.59095847 880.59095847 880.59095847 880.59095847 1000000.0 0.06533112721873159 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0017374695350339127 1000000.0 1000000.0 1000000.0 1000000.0 0.0 7.008745564472442 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 61.48022424975827 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 0.9 54.333904493699734 73.87691083331325 58.7105 42.1347 0 16 0 0 0 0 0 17 0 0 0 0 -0 PI(18:1_18:2)+H PI(36:3)+H PI (18:1_18:2) (18:1) (18:2) 861.54875947 C45 H82 O13 N0 P1 6085024.82 2199248.605 7.4830141130693395 0.2340827025787267 2.7216149943766967 0.96 191.0410177135529 0.0 6064914.063 0.0 0.0 0.0 0.0 0.0 6085024.82 0.0 0.0 0.0 0.0 0.0 2116199.006 0.0 0.0 0.0 0.0 0.0 2199248.605 0.0 0.0 0.0 0.0 7.486 7.484 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.95 0.96 -6029 -6028 -6027 -6026 -6025 -6024 -6023 288 -6022 -6021 -6020 -6019 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 861.54876 861.549046 7.4830141130693395 7.486 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.484 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 625292.0 1 1 1 1 1 1 1 1 1 1 1 1 861.54875947 5.299999656926957E-7 861.54875947 861.54875947 861.54875947 861.54875947 861.54875947 2.8652999992573314E-4 861.54875947 861.54875947 861.54875947 861.54875947 1000000.0 6.151711784934103E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.33257548893924255 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.868887625581204 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.722477115404715 0.0 0.0 0.0 0.0 0.99 0.96 847.9904304154765 191.0410177135529 19.2258 17.4443 0 12 0 0 0 0 0 13 0 0 0 0 -0 PI(36:3)+NH4 PI(36:3)+NH4 PI (18:1_18:2) (18:1) (18:2) 878.57530847 C45 H85 O13 N1 P1 5145212.194 1957637.868 7.4830141130693395 2.0645833422277358 7.677554134172358 0.98 2136477.5 0.0 4997145.848 0.0 0.0 0.0 0.0 0.0 5145212.194 0.0 0.0 0.0 0.0 0.0 1756028.471 0.0 0.0 0.0 0.0 0.0 1957637.868 0.0 0.0 0.0 0.0 7.486 7.484 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.96 0.97 -6039 284 -6038 -6037 -6036 -6035 -6034 294 -6033 -6032 -6031 -6030 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 878.57607 878.575792 7.4830141130693395 7.486 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.484 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 299225.5625 413212.625 1 1 1 1 1 1 1 1 1 1 1 1 878.57530847 7.615299999770286E-4 878.57530847 878.57530847 878.57530847 878.57530847 878.57530847 4.8352999999679014E-4 878.57530847 878.57530847 878.57530847 878.57530847 1000000.0 0.8667782859766449 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5503569191340424 1000000.0 1000000.0 1000000.0 1000000.0 0.0 7.09978539437904 0.0 0.0 0.0 0.0 0.0 6.763794820396464 0.0 0.0 0.0 0.0 C C 0.0 62.8299592422924 0.0 0.0 0.0 0.0 0.0 59.856591330942166 0.0 0.0 0.0 0.0 0.99 0.98 198.3028217835302 2136477.5 26.396 10.5979 0 13 0 0 0 0 0 13 0 0 0 0 -0 PI(36:3)+Na PI(36:3)+Na PI (18:1_18:2) (18:1) (18:2) 883.53070447 C45 H81 O13 N0 P1 Na1 4127286.919 1798776.938 7.4830141130693395 2.327169633578277 1.8791478279028062 0.98 84.36196775203506 0.0 4127286.919 0.0 0.0 0.0 0.0 0.0 3993652.202 0.0 0.0 0.0 0.0 0.0 1751601.001 0.0 0.0 0.0 0.0 0.0 1798776.938 0.0 0.0 0.0 0.0 7.476 7.474 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -6050 285 -6049 -6048 -6047 -6046 -6045 -6044 -6043 -6042 -6041 -6040 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 883.529596 883.5307 7.4830141130693395 7.476 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.474 7.4830141130693395 7.4830141130693395 7.4830141130693395 7.4830141130693395 401540.5625 1 1 1 1 1 1 1 1 1 1 1 1 883.53070447 0.0011084700000765224 883.53070447 883.53070447 883.53070447 883.53070447 883.53070447 4.470000021683518E-6 883.53070447 883.53070447 883.53070447 883.53070447 1000000.0 1.2545913735295207 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005059246949844169 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.008161665222884 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 28.747185001066434 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.98 84.36196775203506 72.2191341428621 11.9797 12.0128 0 13 0 0 0 0 0 12 0 0 0 0 -0 PI(18:1_18:3)+H PI(36:4)+H PI (18:1_18:3) (18:1) (18:3) 859.5331094700001 C45 H80 O13 N0 P1 1.8430667363E7 8582639.657 7.143407677751897 44.01429861075366 47.073048242801725 0.99 1605.9993940589336 0.0 1.8430667363E7 7985189.011 0.0 0.0 0.0 0.0 1.7501252774E7 8146334.271 0.0 0.0 0.0 0.0 8582639.657 3103271.499 0.0 0.0 0.0 0.0 7034687.955 3684647.673 0.0 0.0 0.0 7.143 7.138 7.147 7.139 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 1.0 0.89 1.0 0.88 -6058 223 1827 -6057 -6056 -6055 -6054 231 1925 -6053 -6052 -6051 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 859.534116 859.532166 859.533214 859.53302 7.143407677751897 7.143 7.138 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 7.147 7.139 7.143407677751897 7.143407677751897 7.143407677751897 369064.34375 2670778.5 671639.6875 4596214.0 1 1 1 1 1 1 1 1 1 1 1 1 859.5331094700001 0.0010065299999268973 9.434700001520469E-4 859.5331094700001 859.5331094700001 859.5331094700001 859.5331094700001 1.0452999993049161E-4 8.947000014813966E-5 859.5331094700001 859.5331094700001 859.5331094700001 1000000.0 1.1710194625865402 1.097654051667426 1000000.0 1000000.0 1000000.0 1000000.0 0.1216125345013716 0.1040913946913669 1000000.0 1000000.0 1000000.0 0.0 6.195240000144918 13.176202397376114 0.0 0.0 0.0 0.0 12.222872277898164 12.910426190155581 0.0 0.0 0.0 C B B B 0.0 54.344210527587 60.71982671601896 0.0 0.0 0.0 0.0 57.11622559765496 59.495051567537246 0.0 0.0 0.0 0.99 0.94 0.98 0.99 1605.9993940589336 3996484.0 1131.5991932331094 4596214.0 32.9878 3.2517 30.8429 6.2386 0 14 8 0 0 0 0 13 6 0 0 0 -0 PI(36:4)+NH4 PI(36:4)+NH4 PI (18:1_18:3) (18:1) (18:3) 876.55965847 C45 H83 O13 N1 P1 1.5444244462E7 7006011.766 7.143407677751897 2.353545307132231 22.47095998002229 0.99 130.46810078282985 0.0 1.5444244462E7 0.0 0.0 0.0 0.0 0.0 1.4938610604E7 0.0 0.0 0.0 0.0 0.0 7006011.766 0.0 0.0 0.0 0.0 0.0 5084850.193 0.0 0.0 0.0 0.0 7.144 7.143 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.87 0.9 -6068 228 -6067 -6066 -6065 -6064 -6063 240 -6062 -6061 -6060 -6059 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 876.559983 876.559859 7.143407677751897 7.144 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 7.143 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 621909.0 651724.0625 1 1 1 1 1 1 1 1 1 1 1 1 876.55965847 3.245299999434792E-4 876.55965847 876.55965847 876.55965847 876.55965847 876.55965847 2.005299999154886E-4 876.55965847 876.55965847 876.55965847 876.55965847 1000000.0 0.3702315031357174 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.22876936895031846 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.8727823430068815 0.0 0.0 0.0 0.0 0.0 7.485096770663025 0.0 0.0 0.0 0.0 C C 0.0 61.36412806256145 0.0 0.0 0.0 0.0 0.0 66.23979443064624 0.0 0.0 0.0 0.0 0.99 0.99 130.46810078282985 6107778.5 34.0815 54.646 0 16 0 0 0 0 0 14 0 0 0 0 -0 PI(36:4)+Na PI(36:4)+Na PI (18:1_18:3) (18:1) (18:3) 881.5150544700001 C45 H79 O13 N0 P1 Na1 6640085.008 2913268.84 7.143407677751897 3.537955035728869 6.757192976545085 0.97 153.94184714245588 0.0 6315962.025 0.0 0.0 0.0 0.0 0.0 6640085.008 0.0 0.0 0.0 0.0 0.0 2647568.847 0.0 0.0 0.0 0.0 0.0 2913268.84 0.0 0.0 0.0 0.0 7.137 7.136 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6079 -6078 -6077 -6076 -6075 -6074 -6073 239 -6072 -6071 -6070 -6069 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 881.51505 881.514617 7.143407677751897 7.137 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 7.136 7.143407677751897 7.143407677751897 7.143407677751897 7.143407677751897 433583.21875 1 1 1 1 1 1 1 1 1 1 1 1 881.5150544700001 4.4700001353703556E-6 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 4.37470000065332E-4 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 1000000.0 0.005070815424766497 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4962705944124293 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.3098070075939825 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 30.190464151167383 0.0 0.0 0.0 0.0 0.96 0.97 175.60238430417286 153.94184714245588 19.5621 27.9431 0 15 0 0 0 0 0 14 0 0 0 0 -0 PI(16:0_20:4)+NH4 PI(36:4)+NH4 PI (16:0_20:4) (16:0) (20:4) 876.55965847 C45 H83 O13 N1 P1 1815779.024 815635.82 7.382076826505493 0.34233700249729326 3.4316986796556965 0.99 159.507570961367 0.0 1815779.024 0.0 0.0 0.0 0.0 0.0 1807009.383 0.0 0.0 0.0 0.0 0.0 815635.82 0.0 0.0 0.0 0.0 0.0 776989.533 0.0 0.0 0.0 0.0 7.382 7.384 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.88 0.91 -6089 259 -6088 -6087 -6086 -6085 -6084 271 -6083 -6082 -6081 -6080 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 876.559547 876.559411 7.382076826505493 7.382 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 7.384 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 436739.03125 608194.25 1 1 1 1 1 1 1 1 1 1 1 1 876.55965847 1.11470000092595E-4 876.55965847 876.55965847 876.55965847 876.55965847 876.55965847 2.474700000902885E-4 876.55965847 876.55965847 876.55965847 876.55965847 1000000.0 0.12716761376762584 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.28231963186879666 1000000.0 1000000.0 1000000.0 1000000.0 0.0 8.809258121755592 0.0 0.0 0.0 0.0 0.0 10.410732717986562 0.0 0.0 0.0 0.0 B B 0.0 42.35220250844035 0.0 0.0 0.0 0.0 0.0 49.1072298018234 0.0 0.0 0.0 0.0 0.99 0.98 159.507570961367 130.17170565372004 13.0114 18.7535 0 9 0 0 0 0 0 8 0 0 0 0 -0 PI(36:4)+Na PI(36:4)+Na PI (16:0_20:4) (16:0) (20:4) 881.5150544700001 C45 H79 O13 N0 P1 Na1 1901890.204 880292.91 7.382076826505493 1.653087355828985 7.0521317237794685 1.0 44.6753056717896 0.0 1857941.186 0.0 0.0 0.0 0.0 0.0 1901890.204 0.0 0.0 0.0 0.0 0.0 796669.34 0.0 0.0 0.0 0.0 0.0 880292.91 0.0 0.0 0.0 0.0 7.381 7.378 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6100 -6099 -6098 -6097 -6096 -6095 -6094 269 -6093 -6092 -6091 -6090 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 881.51505 881.515168 7.382076826505493 7.381 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 7.378 7.382076826505493 7.382076826505493 7.382076826505493 7.382076826505493 382324.4375 1 1 1 1 1 1 1 1 1 1 1 1 881.5150544700001 4.4700001353703556E-6 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 1.135299999077688E-4 881.5150544700001 881.5150544700001 881.5150544700001 881.5150544700001 1000000.0 0.005070815424766497 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.12878963249927397 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.025553958077418 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.4550188479877 0.0 0.0 0.0 0.0 1.0 1.0 51.89316304669888 44.6753056717896 13.8663 12.5675 0 8 0 0 0 0 0 7 0 0 0 0 -0 PI(36:5)+NH4 PI(36:5)+NH4 PI (36:5) (36:5) 874.54400847 C45 H81 O13 N1 P1 4792652.796 2043891.505 6.749992342766643 6.569423040683871 7.518487834148901 0.98 97.77967425994245 0.0 4792652.796 0.0 0.0 0.0 0.0 0.0 4367153.804 0.0 0.0 0.0 0.0 0.0 2043891.505 0.0 0.0 0.0 0.0 0.0 1837540.095 0.0 0.0 0.0 0.0 6.75 6.752 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6110 172 -6109 -6108 -6107 -6106 -6105 182 -6104 -6103 -6102 -6101 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 874.544151 874.544279 6.749992342766643 6.75 6.749992342766643 6.749992342766643 6.749992342766643 6.749992342766643 6.749992342766643 6.752 6.749992342766643 6.749992342766643 6.749992342766643 6.749992342766643 526186.4375 596120.9375 1 1 1 1 1 1 1 1 1 1 1 1 874.54400847 1.425300000619245E-4 874.54400847 874.54400847 874.54400847 874.54400847 874.54400847 2.7052999996612925E-4 874.54400847 874.54400847 874.54400847 874.54400847 1000000.0 0.16297636103102273 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.30933834929521375 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.665056765806972 0.0 0.0 0.0 0.0 0.0 6.647555595021585 0.0 0.0 0.0 0.0 C C 0.0 57.45738591212907 0.0 0.0 0.0 0.0 0.0 60.43232359110533 0.0 0.0 0.0 0.0 0.98 0.98 97.77967425994245 68.08998425135424 19.391 21.7153 0 13 0 0 0 0 0 13 0 0 0 0 -0 PI(36:5)+H PI(36:5)+H PI (36:5) (36:5) 857.5174594700001 C45 H78 O13 N0 P1 5488033.315 2564945.241 6.749992342766643 11.883694582695979 17.536435148700114 0.98 1.3930635654676027 0.0 4418930.064 5488033.315 0.0 0.0 0.0 0.0 4247765.047 5024938.224 0.0 0.0 0.0 0.0 1844888.534 2308899.13 0.0 0.0 0.0 0.0 1790751.639 2564945.241 0.0 0.0 0.0 6.751 6.746 6.75 6.748 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -6118 175 1658 -6117 -6116 -6115 -6114 181 1755 -6113 -6112 -6111 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 857.518057 857.514641 857.518486 857.51481 6.749992342766643 6.751 6.746 6.749992342766643 6.749992342766643 6.749992342766643 6.749992342766643 6.75 6.748 6.749992342766643 6.749992342766643 6.749992342766643 491812.15625 1597129.25 636130.6875 2430318.25 1 1 1 1 1 1 1 1 1 1 1 1 857.5174594700001 5.975299999363415E-4 0.0028184700000792873 857.5174594700001 857.5174594700001 857.5174594700001 857.5174594700001 0.001026529999990089 0.002649470000051224 857.5174594700001 857.5174594700001 857.5174594700001 1000000.0 0.6968138005092663 3.286778559379164 1000000.0 1000000.0 1000000.0 1000000.0 1.197095159583747 3.0896980239781513 1000000.0 1000000.0 1000000.0 0.0 6.198839583066099 5.753364817583644 0.0 0.0 0.0 0.0 5.8057490810968595 5.751921452272122 0.0 0.0 0.0 C C C C 0.0 55.3467819916616 52.303316523487666 0.0 0.0 0.0 0.0 52.30404577564739 51.81911218263174 0.0 0.0 0.0 0.99 0.98 0.98 0.99 164.5853043444517 1.3930635654676027 260.73857196688124 1.0909963059008538 13.7108 3.4145 15.7773 3.0225 0 15 8 0 0 0 0 16 5 0 0 0 -0 PI(16:0_20:5)+NH4 PI(36:5)+NH4 PI (16:0_20:5) (16:0) (20:5) 874.54400847 C45 H81 O13 N1 P1 1281184.923 519936.022 7.041004689546103 4.776865382362951 0.28605211329879554 1.0 21.013352593763322 0.0 1197462.319 0.0 0.0 0.0 0.0 0.0 1281184.923 0.0 0.0 0.0 0.0 0.0 519936.022 0.0 0.0 0.0 0.0 0.0 517836.925 0.0 0.0 0.0 0.0 7.042 7.04 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.88 0.89 -6128 209 -6127 -6126 -6125 -6124 -6123 219 -6122 -6121 -6120 -6119 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 874.544136 874.544419 7.041004689546103 7.042 7.041004689546103 7.041004689546103 7.041004689546103 7.041004689546103 7.041004689546103 7.04 7.041004689546103 7.041004689546103 7.041004689546103 7.041004689546103 310140.96875 433643.3125 1 1 1 1 1 1 1 1 1 1 1 1 874.54400847 1.2752999998610903E-4 874.54400847 874.54400847 874.54400847 874.54400847 874.54400847 4.1052999995372375E-4 874.54400847 874.54400847 874.54400847 874.54400847 1000000.0 0.14582456543178499 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.46942177406479413 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.3970640468761255 0.0 0.0 0.0 0.0 0.0 10.836092244849313 0.0 0.0 0.0 0.0 B B 0.0 31.358157092530032 0.0 0.0 0.0 0.0 0.0 50.873672511029646 0.0 0.0 0.0 0.0 1.0 1.0 28.89018102360795 21.013352593763322 12.9208 22.1641 0 9 0 0 0 0 0 9 0 0 0 0 -0 PI(18:3_18:3)+H PI(36:6)+H PI (18:3_18:3) (18:3) (18:3) 855.5018094700001 C45 H76 O13 N0 P1 6019954.306 2176828.875 6.329056315966658 29.291382506011903 25.957257483807368 0.98 15.12553604319364 0.0 3386682.804 6019954.306 0.0 0.0 0.0 0.0 3574389.615 5616688.021 0.0 0.0 0.0 0.0 1335296.43 2176828.875 0.0 0.0 0.0 0.0 1359505.917 2071128.821 0.0 0.0 0.0 6.33 6.325 6.325 6.331 0.0 0.018 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.022 0.024 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.91 0.92 1.0 0.89 -6137 -6136 1475 -6135 -6134 -6133 -6132 120 1572 -6131 -6130 -6129 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 855.50181 855.501296 855.502826 855.501248 6.329056315966658 6.33 6.325 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 6.325 6.331 6.329056315966658 6.329056315966658 6.329056315966658 2096670.375 405892.96875 1827213.375 1 1 1 1 1 1 1 1 1 1 1 1 855.5018094700001 5.29999852005858E-7 5.134700001008241E-4 855.5018094700001 855.5018094700001 855.5018094700001 855.5018094700001 0.0010165299999016497 5.614700000933226E-4 855.5018094700001 855.5018094700001 855.5018094700001 1000000.0 6.195192647625177E-4 0.6001974448410912 1000000.0 1000000.0 1000000.0 1000000.0 1.1882265924503534 0.6563048656100028 1000000.0 1000000.0 1000000.0 0.0 0.0 16.26851117737815 0.0 0.0 0.0 0.0 5.290595908923459 16.43375603661593 0.0 0.0 0.0 A C A 0.0 0.0 52.14266403005817 0.0 0.0 0.0 0.0 48.986999156698694 52.50401289653652 0.0 0.0 0.0 0.99 0.98 1.0 0.99 21.378505572788047 15.12553604319364 13.70266230360228 17.141889365509964 22.1164 4.9034 22.428 20.0701 0 17 10 0 0 0 0 17 10 0 0 0 -0 PI(36:6)+Na PI(36:6)+Na PI (18:3_18:3) (18:3) (18:3) 877.4837544700001 C45 H75 O13 N0 P1 Na1 6243024.478 2461304.052 6.329056315966658 0.7013517562929503 4.936754011799119 1.0 118.20321113265678 0.0 6243024.478 0.0 0.0 0.0 0.0 0.0 6181407.918 0.0 0.0 0.0 0.0 0.0 2461304.052 0.0 0.0 0.0 0.0 0.0 2295261.287 0.0 0.0 0.0 0.0 6.333 6.329 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 1.0 0.91 -6147 115 -6146 -6145 -6144 -6143 -6142 118 -6141 -6140 -6139 -6138 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 877.483889 877.484051 6.329056315966658 6.333 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 6.329 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 610922.5625 683123.125 1 1 1 1 1 1 1 1 1 1 1 1 877.4837544700001 1.345299998547489E-4 877.4837544700001 877.4837544700001 877.4837544700001 877.4837544700001 877.4837544700001 2.9652999990048556E-4 877.4837544700001 877.4837544700001 877.4837544700001 877.4837544700001 1000000.0 0.1533133795006894 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3379321820944589 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.976351847774946 0.0 0.0 0.0 0.0 0.0 6.677568947304361 0.0 0.0 0.0 0.0 C C 0.0 28.732460806610316 0.0 0.0 0.0 0.0 0.0 32.103696862040195 0.0 0.0 0.0 0.0 1.0 1.0 118.20321113265678 275.7628819581157 49.3492 51.902 0 16 0 0 0 0 0 18 0 0 0 0 -0 PI(36:6)+NH4 PI(36:6)+NH4 PI (18:3_18:3) (18:3) (18:3) 872.5283584700001 C45 H79 O13 N1 P1 4498616.329 1788839.11 6.329056315966658 10.844280952147981 8.43968792669078 0.99 88.12293821270305 0.0 4498616.329 0.0 0.0 0.0 0.0 0.0 3857838.012 0.0 0.0 0.0 0.0 0.0 1788839.11 0.0 0.0 0.0 0.0 0.0 1587355.877 0.0 0.0 0.0 0.0 6.331 6.325 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 1.0 0.95 -6157 116 -6156 -6155 -6154 -6153 -6152 119 -6151 -6150 -6149 -6148 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 872.529071 872.529021 6.329056315966658 6.331 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 6.325 6.329056315966658 6.329056315966658 6.329056315966658 6.329056315966658 490924.25 498607.75 1 1 1 1 1 1 1 1 1 1 1 1 872.5283584700001 7.125299999870549E-4 872.5283584700001 872.5283584700001 872.5283584700001 872.5283584700001 872.5283584700001 6.625299998859191E-4 872.5283584700001 872.5283584700001 872.5283584700001 872.5283584700001 1000000.0 0.816626752666806 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7593220248424725 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.551945079844311 0.0 0.0 0.0 0.0 0.0 6.366089059093898 0.0 0.0 0.0 0.0 C C 0.0 51.88733719480664 0.0 0.0 0.0 0.0 0.0 58.945269065684236 0.0 0.0 0.0 0.0 0.99 0.96 88.12293821270305 1648354.63 8.4786 14.3373 0 16 0 0 0 0 0 18 0 0 0 0 -0 PI(38:2)+NH4 PI(38:2)+NH4 PI (38:2) (38:2) 908.62225847 C47 H91 O13 N1 P1 970644.229 326973.048 8.174914944964287 14.186977405893956 5.541231669656159 0.97 6.228802359795854 0.0 970644.229 0.0 0.0 0.0 0.0 0.0 793654.894 0.0 0.0 0.0 0.0 0.0 326973.048 0.0 0.0 0.0 0.0 0.0 302315.978 0.0 0.0 0.0 0.0 8.176 8.178 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6168 401 -6167 -6166 -6165 -6164 -6163 -6162 -6161 -6160 -6159 -6158 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 908.622202 908.62226 8.174914944964287 8.176 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 8.178 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 251469.34375 1 1 1 1 1 1 1 1 1 1 1 1 908.62225847 5.6470000004082976E-5 908.62225847 908.62225847 908.62225847 908.62225847 908.62225847 1.5299999631679384E-6 908.62225847 908.62225847 908.62225847 908.62225847 1000000.0 0.06214903880868053 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0016838680198570707 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.652917589531314 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 58.87537689850721 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.97 6.228802359795854 4.506845039185198 13.8385 10.6704 0 11 0 0 0 0 0 10 0 0 0 0 -0 PI(38:2)+H PI(38:2)+H PI (38:2) (38:2) 891.5957094700001 C47 H88 O13 N0 P1 1117924.842 367163.18 8.174914944964287 23.99241556874246 4.944487874034311 0.96 400036.0 0.0 1117924.842 0.0 0.0 0.0 0.0 0.0 793626.362 0.0 0.0 0.0 0.0 0.0 342356.383 0.0 0.0 0.0 0.0 0.0 367163.18 0.0 0.0 0.0 0.0 8.17 8.178 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 1.0 -6179 403 -6178 -6177 -6176 -6175 -6174 -6173 -6172 -6171 -6170 -6169 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 891.596104 891.59571 8.174914944964287 8.17 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 8.178 8.174914944964287 8.174914944964287 8.174914944964287 8.174914944964287 400036.0 1 1 1 1 1 1 1 1 1 1 1 1 891.5957094700001 3.94529999880433E-4 891.5957094700001 891.5957094700001 891.5957094700001 891.5957094700001 891.5957094700001 5.299999656926957E-7 891.5957094700001 891.5957094700001 891.5957094700001 891.5957094700001 1000000.0 0.44249876450724207 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.944397893163357E-4 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.08965497099044 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 46.26959064536764 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.91 400036.0 68.37592126149272 46.7605 2.9234 0 8 0 0 0 0 0 7 0 0 0 0 -0 PI(18:0_20:4)+NH4 PI(38:4)+NH4 PI (18:0_20:4) (18:0) (20:4) 904.59095847 C47 H87 O13 N1 P1 2201837.636 1060924.091 7.788989488030464 0.4898001948453005 6.9414921716971545 0.99 19.260554240813814 0.0 2186638.542 0.0 0.0 0.0 0.0 0.0 2201837.636 0.0 0.0 0.0 0.0 0.0 1060924.091 0.0 0.0 0.0 0.0 0.0 961648.614 0.0 0.0 0.0 0.0 7.788 7.791 0.0 0.015 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.98 0.91 -6189 327 -6188 -6187 -6186 -6185 -6184 339 -6183 -6182 -6181 -6180 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 904.590039 904.590116 7.788989488030464 7.788 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.791 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 1258216.5 939454.25 1 1 1 1 1 1 1 1 1 1 1 1 904.59095847 9.194699999852673E-4 904.59095847 904.59095847 904.59095847 904.59095847 904.59095847 8.424700000659868E-4 904.59095847 904.59095847 904.59095847 904.59095847 1000000.0 1.0164483641760398 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9313270182259141 1000000.0 1000000.0 1000000.0 1000000.0 0.0 12.481927452525763 0.0 0.0 0.0 0.0 0.0 11.737589832247174 0.0 0.0 0.0 0.0 A B 0.0 40.5257384822265 0.0 0.0 0.0 0.0 0.0 55.893284915462736 0.0 0.0 0.0 0.0 0.99 0.99 11.601230315467157 19.260554240813814 38.7369 38.2213 0 6 0 0 0 0 0 7 0 0 0 0 -0 PI(18:0_20:4)+Na PI(38:4)+Na PI (18:0_20:4) (18:0) (20:4) 909.5463544700001 C47 H83 O13 N0 P1 Na1 2105661.516 1131924.66 7.788989488030464 15.160119548301296 16.1090417672694 0.99 1.9485286906468782 0.0 1697923.881 0.0 0.0 0.0 0.0 0.0 2105661.516 0.0 0.0 0.0 0.0 0.0 900423.669 0.0 0.0 0.0 0.0 0.0 1131924.66 0.0 0.0 0.0 0.0 7.787 7.791 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6200 -6199 -6198 -6197 -6196 -6195 -6194 341 -6193 -6192 -6191 -6190 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 909.54635 909.544213 7.788989488030464 7.787 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.791 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 1125356.0 1 1 1 1 1 1 1 1 1 1 1 1 909.5463544700001 4.4700001353703556E-6 909.5463544700001 909.5463544700001 909.5463544700001 909.5463544700001 909.5463544700001 0.0021414700000832454 909.5463544700001 909.5463544700001 909.5463544700001 909.5463544700001 1000000.0 0.004914538014915205 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3544374506685775 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.337986040446651 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.13457064245721 0.0 0.0 0.0 0.0 0.98 0.99 48.63934505104159 1.9485286906468782 6.3228 7.1066 0 7 0 0 0 0 0 7 0 0 0 0 -0 PI(18:0_20:4)+H PI(38:4)+H PI (18:0_20:4) (18:0) (20:4) 887.5644094700001 C47 H84 O13 N0 P1 3259297.073 1640515.692 7.788989488030464 2.191800292436328 0.688741500226481 1.0 -0.2408460691785217 0.0 3259297.073 0.0 0.0 0.0 0.0 0.0 3159811.365 0.0 0.0 0.0 0.0 0.0 1640515.692 0.0 0.0 0.0 0.0 0.0 1624614.06 0.0 0.0 0.0 0.0 7.79 7.792 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6211 326 -6210 -6209 -6208 -6207 -6206 -6205 -6204 -6203 -6202 -6201 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 887.563156 887.56441 7.788989488030464 7.79 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 7.792 7.788989488030464 7.788989488030464 7.788989488030464 7.788989488030464 1206547.75 1 1 1 1 1 1 1 1 1 1 1 1 887.5644094700001 0.0012534700000514931 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 5.29999852005858E-7 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 1000000.0 1.4122580701495113 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.971395949983414E-4 1000000.0 1000000.0 1000000.0 1000000.0 0.0 7.809941929213296 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 37.190199662920456 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.98 -0.2408460691785217 6.4589666241112615 6.8822 5.9216 0 9 0 0 0 0 0 8 0 0 0 0 -0 PI(18:0_20:4)+H PI(38:4)+H PI (18:0_20:4) (18:0) (20:4) 887.5644094700001 C47 H84 O13 N0 P1 9424749.884 5093558.96 7.941 3.2351025403385476 5.333904637605754 0.99 18.35993014840397 0.0 9003198.955 0.0 0.0 0.0 0.0 0.0 9424749.884 0.0 0.0 0.0 0.0 0.0 4723302.281 0.0 0.0 0.0 0.0 0.0 5093558.96 0.0 0.0 0.0 0.0 7.935 7.938 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6222 -6221 -6220 -6219 -6218 -6217 -6216 334 -6215 -6214 -6213 -6212 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 887.56441 887.56325 7.941 7.935 7.941 7.941 7.941 7.941 7.941 7.938 7.941 7.941 7.941 7.941 586804.125 1 1 1 1 1 1 1 1 1 1 1 1 887.5644094700001 5.29999852005858E-7 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 0.0011594700000614466 887.5644094700001 887.5644094700001 887.5644094700001 887.5644094700001 1000000.0 5.971395949983414E-4 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.30635026336152 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.996556379682703 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 38.44498259462838 0.0 0.0 0.0 0.0 1.0 0.99 17.06678447725442 18.35993014840397 2.8524 3.252 0 8 0 0 0 0 0 8 0 0 0 0 -0 PI(38:5)+H PI(38:5)+H PI (38:5) (38:5) 885.54875947 C47 H82 O13 N0 P1 1413520.231 520328.328 7.212 0.560267388715669 1.5115513266727905 0.97 500291.88 0.0 1402364.572 0.0 0.0 0.0 0.0 0.0 1413520.231 0.0 0.0 0.0 0.0 0.0 509323.123 0.0 0.0 0.0 0.0 0.0 520328.328 0.0 0.0 0.0 0.0 7.21 7.216 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6233 234 -6232 -6231 -6230 -6229 -6228 -6227 -6226 -6225 -6224 -6223 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 885.547739 885.54876 7.212 7.21 7.212 7.212 7.212 7.212 7.212 7.216 7.212 7.212 7.212 7.212 470408.28125 1 1 1 1 1 1 1 1 1 1 1 1 885.54875947 0.0010204700000713274 885.54875947 885.54875947 885.54875947 885.54875947 885.54875947 5.299999656926957E-7 885.54875947 885.54875947 885.54875947 885.54875947 1000000.0 1.1523589064503659 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.98498908191007E-4 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.639054831885154 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 50.34870385611745 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.97 6.964546553869477 500291.88 13.9598 13.7229 0 16 0 0 0 0 0 18 0 0 0 0 -0 PI(38:6)+NH4 PI(38:6)+NH4 PI (38:6) (38:6) 900.55965847 C47 H83 O13 N1 P1 1163192.007 481733.479 6.85002487346018 3.673166171264921 11.44258422979779 1.0 468113.5 0.0 1104298.019 0.0 0.0 0.0 0.0 0.0 1163192.007 0.0 0.0 0.0 0.0 0.0 409613.45 0.0 0.0 0.0 0.0 0.0 481733.479 0.0 0.0 0.0 0.0 6.847 6.849 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6243 183 -6242 -6241 -6240 -6239 -6238 190 -6237 -6236 -6235 -6234 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 900.559209 900.559225 6.85002487346018 6.847 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 6.849 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 363945.0 448993.15625 1 1 1 1 1 1 1 1 1 1 1 1 900.55965847 4.494700000350349E-4 900.55965847 900.55965847 900.55965847 900.55965847 900.55965847 4.33470000075431E-4 900.55965847 900.55965847 900.55965847 900.55965847 1000000.0 0.4991007489705446 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4813340193495588 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.955163034502179 0.0 0.0 0.0 0.0 0.0 6.1721604429639765 0.0 0.0 0.0 0.0 C C 0.0 54.63452325231356 0.0 0.0 0.0 0.0 0.0 56.11054948149069 0.0 0.0 0.0 0.0 1.0 1.0 1965.7972602068323 468113.5 34.2046 30.7228 0 10 0 0 0 0 0 11 0 0 0 0 -0 PI(38:6)+H PI(38:6)+H PI (38:6) (38:6) 883.5331094700001 C47 H80 O13 N0 P1 1341179.664 556321.315 6.85002487346018 4.0681002733634 9.126957210037116 0.99 693.9190214737303 0.0 1341179.664 0.0 0.0 0.0 0.0 0.0 1266176.932 0.0 0.0 0.0 0.0 0.0 556321.315 0.0 0.0 0.0 0.0 0.0 488867.609 0.0 0.0 0.0 0.0 6.855 6.852 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 1.0 0.95 -6254 184 -6253 -6252 -6251 -6250 -6249 -6248 -6247 -6246 -6245 -6244 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 883.532714 883.53311 6.85002487346018 6.855 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 6.852 6.85002487346018 6.85002487346018 6.85002487346018 6.85002487346018 377504.71875 1 1 1 1 1 1 1 1 1 1 1 1 883.5331094700001 3.9547000005768496E-4 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 5.29999852005858E-7 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 1000000.0 0.44760065674835126 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 5.998641661813736E-4 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.287881487913418 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 49.88567441427752 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 693.9190214737303 225.49235771693577 27.2314 24.0534 0 10 0 0 0 0 0 12 0 0 0 0 -0 PI(18:1_20:5)+NH4 PI(38:6)+NH4 PI (18:1_20:5) (18:1) (20:5) 900.55965847 C47 H83 O13 N1 P1 1726541.056 551552.262 7.078905343223025 4.823127967169347 4.798086707235876 1.0 36.93699590037614 0.0 1726541.056 0.0 0.0 0.0 0.0 0.0 1612658.765 0.0 0.0 0.0 0.0 0.0 551552.262 0.0 0.0 0.0 0.0 0.0 515354.674 0.0 0.0 0.0 0.0 7.084 7.078 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6264 213 -6263 -6262 -6261 -6260 -6259 224 -6258 -6257 -6256 -6255 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 900.559911 900.55994 7.078905343223025 7.084 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 7.078 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 296452.6875 341783.65625 1 1 1 1 1 1 1 1 1 1 1 1 900.55965847 2.525300000115749E-4 900.55965847 900.55965847 900.55965847 900.55965847 900.55965847 2.815299999383569E-4 900.55965847 900.55965847 900.55965847 900.55965847 1000000.0 0.28041451517005445 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3126167126080913 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.509701633619415 0.0 0.0 0.0 0.0 0.0 10.140169411153057 0.0 0.0 0.0 0.0 B B 0.0 27.008341341271645 0.0 0.0 0.0 0.0 0.0 48.28652100549075 0.0 0.0 0.0 0.0 1.0 1.0 36.93699590037614 44.020648930590106 27.3062 21.8548 0 11 0 0 0 0 0 12 0 0 0 0 -0 PI(18:1_20:5)+H PI(38:6)+H PI (18:1_20:5) (18:1) (20:5) 883.5331094700001 C47 H80 O13 N0 P1 2974874.902 663977.448 7.078905343223025 2.501522186962117 1.7199707679400438 0.89 -0.17018699713606777 0.0 2974874.902 0.0 0.0 0.0 0.0 0.0 2871462.357 0.0 0.0 0.0 0.0 0.0 663977.448 0.0 0.0 0.0 0.0 0.0 648020.885 0.0 0.0 0.0 0.0 7.079 7.075 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6274 212 -6273 -6272 -6271 -6270 -6269 223 -6268 -6267 -6266 -6265 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 883.533569 883.533752 7.078905343223025 7.079 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 7.075 7.078905343223025 7.078905343223025 7.078905343223025 7.078905343223025 396517.5 252123.9375 1 1 1 1 1 1 1 1 1 1 1 1 883.5331094700001 4.595299999436975E-4 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 6.425299999364142E-4 883.5331094700001 883.5331094700001 883.5331094700001 883.5331094700001 1000000.0 0.5201050136302793 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7272279816676537 1000000.0 1000000.0 1000000.0 1000000.0 0.0 9.687478447118695 0.0 0.0 0.0 0.0 0.0 7.6609970839513775 0.0 0.0 0.0 0.0 B B 0.0 45.481119470040824 0.0 0.0 0.0 0.0 0.0 37.009647748557384 0.0 0.0 0.0 0.0 0.89 0.86 -0.17018699713606777 7.763107306640699 6.4957 8.1424 0 24 0 0 0 0 0 22 0 0 0 0 -0 PS(18:0_18:1)+H PS(36:1)+H PS (18:0_18:1) (18:0) (18:1) 790.5592634700001 C42 H81 O10 N1 P1 2.028105936E7 5346426.818 8.241 4.59803770184646 6.9073921724531475 0.91 17.605953840952676 0.0 0.0 1.9003789635E7 0.0 0.0 0.0 0.0 0.0 2.028105936E7 0.0 0.0 0.0 0.0 0.0 5346426.818 0.0 0.0 0.0 0.0 0.0 4848480.639 0.0 0.0 0.0 8.243 8.247 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6285 -6284 2338 -6283 -6282 -6281 -6280 -6279 -6278 -6277 -6276 -6275 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 790.557874 790.55926 8.241 8.241 8.243 8.241 8.241 8.241 8.241 8.241 8.247 8.241 8.241 8.241 4412917.0 1 1 1 1 1 1 1 1 1 1 1 1 790.5592634700001 790.5592634700001 0.0013894700001628735 790.5592634700001 790.5592634700001 790.5592634700001 790.5592634700001 790.5592634700001 3.470000137895113E-6 790.5592634700001 790.5592634700001 790.5592634700001 1000000.0 1000000.0 1.7575785451732937 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004389297928993012 1000000.0 1000000.0 1000000.0 0.0 0.0 9.519422844556543 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 45.115748078467035 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.91 19.715674235193735 17.605953840952676 10.6645 12.9968 0 0 21 0 0 0 0 0 20 0 0 0 -0 PS(18:0_18:2)+Na PS(36:2)+Na PS (18:0_18:2) (18:0) (18:2) 810.5255584700001 C42 H78 O10 N1 P1 Na1 1.3489818605E7 3999431.779 7.5786239460515095 13.08022772275759 17.373982968628706 0.68 3750412.0 0.0 0.0 1.3489818605E7 0.0 0.0 0.0 0.0 0.0 1.1205700931E7 0.0 0.0 0.0 0.0 0.0 3999431.779 0.0 0.0 0.0 0.0 0.0 3124266.803 0.0 0.0 0.0 7.568 7.591 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6295 -6294 2030 -6293 -6292 -6291 -6290 -6289 2122 -6288 -6287 -6286 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 810.524964 810.52576 7.5786239460515095 7.5786239460515095 7.568 7.5786239460515095 7.5786239460515095 7.5786239460515095 7.5786239460515095 7.5786239460515095 7.591 7.5786239460515095 7.5786239460515095 7.5786239460515095 3722039.75 1948486.75 1 1 1 1 1 1 1 1 1 1 1 1 810.5255584700001 810.5255584700001 5.944700001236924E-4 810.5255584700001 810.5255584700001 810.5255584700001 810.5255584700001 810.5255584700001 2.0152999991296383E-4 810.5255584700001 810.5255584700001 810.5255584700001 1000000.0 1000000.0 0.7334376984309441 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2486411413026688 1000000.0 1000000.0 1000000.0 0.0 0.0 12.950950486512957 0.0 0.0 0.0 0.0 0.0 13.105377844326059 0.0 0.0 0.0 B B 0.0 0.0 41.77725963391276 0.0 0.0 0.0 0.0 0.0 42.00441616771172 0.0 0.0 0.0 0.68 0.87 3750412.0 5.996582118437626 5.0277 3.974 0 0 16 0 0 0 0 0 13 0 0 0 -0 PS(18:1_18:1)+H PS(36:2)+H PS (18:1_18:1) (18:1) (18:1) 788.5436134700001 C42 H79 O10 N1 P1 6.0476173733E7 1.2110273248E7 7.948 1.0623196286853678 3.59478220163132 0.98 27.71754223750906 0.0 0.0 5.9574385847E7 0.0 0.0 0.0 0.0 0.0 6.0476173733E7 0.0 0.0 0.0 0.0 0.0 1.1509873938E7 0.0 0.0 0.0 0.0 0.0 1.2110273248E7 0.0 0.0 0.0 7.949 7.942 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6306 -6305 2178 -6304 -6303 -6302 -6301 -6300 -6299 -6298 -6297 -6296 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 788.540437 788.54361 7.948 7.948 7.949 7.948 7.948 7.948 7.948 7.948 7.942 7.948 7.948 7.948 3491932.5 1 1 1 1 1 1 1 1 1 1 1 1 788.5436134700001 788.5436134700001 0.003176470000084919 788.5436134700001 788.5436134700001 788.5436134700001 788.5436134700001 788.5436134700001 3.470000137895113E-6 788.5436134700001 788.5436134700001 788.5436134700001 1000000.0 1000000.0 4.028274334892913 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004400517712172337 1000000.0 1000000.0 1000000.0 0.0 0.0 16.29130968677964 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 51.883151868724966 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.98 28.158307772165564 27.71754223750906 13.2791 8.3436 0 0 24 0 0 0 0 0 22 0 0 0 -0 PS(36:3)+Na PS(36:3)+Na PS (36:3) (36:3) 808.50990847 C42 H76 O10 N1 P1 Na1 1.8652976672E7 5054644.774 6.93 24.25560391543052 11.172186491312877 0.96 5036974.5 0.0 0.0 1.3191273203E7 0.0 0.0 0.0 0.0 0.0 1.8652976672E7 0.0 0.0 0.0 0.0 0.0 4314489.81 0.0 0.0 0.0 0.0 0.0 5054644.774 0.0 0.0 0.0 6.931 6.933 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 1.0 -6317 -6316 1727 -6315 -6314 -6313 -6312 -6311 -6310 -6309 -6308 -6307 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.511346 808.50991 6.93 6.93 6.931 6.93 6.93 6.93 6.93 6.93 6.933 6.93 6.93 6.93 2686055.0 1 1 1 1 1 1 1 1 1 1 1 1 808.50990847 808.50990847 0.0014375299999755953 808.50990847 808.50990847 808.50990847 808.50990847 808.50990847 1.5299999631679384E-6 808.50990847 808.50990847 808.50990847 1000000.0 1000000.0 1.7779992365163886 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0018923700837052998 1000000.0 1000000.0 1000000.0 0.0 0.0 6.323385923547425 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 55.959167465021466 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.96 5051285.0 5036974.5 5.0598 5.8157 0 0 14 0 0 0 0 0 19 0 0 0 -0 PS(36:5)+Na PS(36:5)+Na PS (36:5) (36:5) 804.47860847 C42 H72 O10 N1 P1 Na1 6107272.366 1455911.06 6.848 25.244286189699 10.84401999493686 0.88 111.07534922523989 0.0 0.0 4257176.219 0.0 0.0 0.0 0.0 0.0 6107272.366 0.0 0.0 0.0 0.0 0.0 1248537.21 0.0 0.0 0.0 0.0 0.0 1455911.06 0.0 0.0 0.0 6.843 6.841 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.81 1.0 -6338 -6337 1688 -6336 -6335 -6334 -6333 -6332 -6331 -6330 -6329 -6328 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 804.476652 804.47861 6.848 6.848 6.843 6.848 6.848 6.848 6.848 6.848 6.841 6.848 6.848 6.848 1313408.625 1 1 1 1 1 1 1 1 1 1 1 1 804.47860847 804.47860847 0.001956470000095578 804.47860847 804.47860847 804.47860847 804.47860847 804.47860847 1.5299999631679384E-6 804.47860847 804.47860847 804.47860847 1000000.0 1000000.0 2.431972683296696 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0019018528859055348 1000000.0 1000000.0 1000000.0 0.0 0.0 6.17660161931486 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 29.83865516577227 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 0.88 73.8273562262621 111.07534922523989 6.7316 6.4285 0 0 12 0 0 0 0 0 19 0 0 0 -0 PS(18:3_18:3)+H PS(36:6)+H PS (18:3_18:3) (18:3) (18:3) 780.4810134700001 C42 H71 O10 N1 P1 4.6695765807E7 1.4607076305E7 6.403179753423526 11.22844193321815 15.476925444324927 0.97 9.312043679000455 0.0 0.0 3.9826176706E7 0.0 0.0 0.0 0.0 0.0 4.6695765807E7 0.0 0.0 0.0 0.0 0.0 1.1725303114E7 0.0 0.0 0.0 0.0 0.0 1.4607076305E7 0.0 0.0 0.0 6.402 6.407 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.82 1.0 -6348 -6347 1500 -6346 -6345 -6344 -6343 -6342 1598 -6341 -6340 -6339 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.481126 780.48058 6.403179753423526 6.403179753423526 6.402 6.403179753423526 6.403179753423526 6.403179753423526 6.403179753423526 6.403179753423526 6.407 6.403179753423526 6.403179753423526 6.403179753423526 4206458.5 4511013.0 1 1 1 1 1 1 1 1 1 1 1 1 780.4810134700001 780.4810134700001 1.1252999991029355E-4 780.4810134700001 780.4810134700001 780.4810134700001 780.4810134700001 780.4810134700001 4.33470000075431E-4 780.4810134700001 780.4810134700001 780.4810134700001 1000000.0 1000000.0 0.14418031696887518 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5553882703029939 1000000.0 1000000.0 1000000.0 0.0 0.0 16.047837356263425 0.0 0.0 0.0 0.0 0.0 16.370800665343765 0.0 0.0 0.0 A A 0.0 0.0 51.600763203419376 0.0 0.0 0.0 0.0 0.0 52.302877525059955 0.0 0.0 0.0 0.96 0.97 7.710094945733387 9.312043679000455 11.3432 13.8931 0 0 20 0 0 0 0 0 15 0 0 0 -0 PS(36:6)+Na PS(36:6)+Na PS (18:3_18:3) (18:3) (18:3) 802.4629584700001 C42 H70 O10 N1 P1 Na1 1.1059161594E7 3355300.677 6.403179753423526 2.1983648043922495 8.096743542527111 0.97 221.48423615061006 0.0 0.0 1.072059985E7 0.0 0.0 0.0 0.0 0.0 1.1059161594E7 0.0 0.0 0.0 0.0 0.0 2991906.424 0.0 0.0 0.0 0.0 0.0 3355300.677 0.0 0.0 0.0 6.402 6.407 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6358 -6357 1505 -6356 -6355 -6354 -6353 -6352 1602 -6351 -6350 -6349 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 802.462841 802.462203 6.403179753423526 6.403179753423526 6.402 6.403179753423526 6.403179753423526 6.403179753423526 6.403179753423526 6.403179753423526 6.407 6.403179753423526 6.403179753423526 6.403179753423526 1613145.75 2176930.75 1 1 1 1 1 1 1 1 1 1 1 1 802.4629584700001 802.4629584700001 1.1747000007744646E-4 802.4629584700001 802.4629584700001 802.4629584700001 802.4629584700001 802.4629584700001 7.55470000058267E-4 802.4629584700001 802.4629584700001 802.4629584700001 1000000.0 1000000.0 0.146386819276267 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9414390933366803 1000000.0 1000000.0 1000000.0 0.0 0.0 15.540747814415067 0.0 0.0 0.0 0.0 0.0 17.51455221346636 0.0 0.0 0.0 C C 0.0 0.0 50.95327152267235 0.0 0.0 0.0 0.0 0.0 56.68139874908207 0.0 0.0 0.0 0.97 0.97 162.43539212763596 221.48423615061006 10.1557 15.8786 0 0 16 0 0 0 0 0 15 0 0 0 -0 PS(38:6)+H PS(38:6)+H PS (38:6) (38:6) 808.5123134700001 C44 H75 O10 N1 P1 1.9468577699E7 5062568.868 6.93 27.974674030932523 11.289325949069056 0.96 5036974.5 0.0 0.0 1.3038354817E7 0.0 0.0 0.0 0.0 0.0 1.9468577699E7 0.0 0.0 0.0 0.0 0.0 4314055.545 0.0 0.0 0.0 0.0 0.0 5062568.868 0.0 0.0 0.0 6.931 6.933 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 1.0 -6369 -6368 -6367 -6366 -6365 -6364 -6363 -6362 1828 -6361 -6360 -6359 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.51231 808.511068 6.93 6.93 6.931 6.93 6.93 6.93 6.93 6.93 6.933 6.93 6.93 6.93 3752664.25 1 1 1 1 1 1 1 1 1 1 1 1 808.5123134700001 808.5123134700001 3.470000137895113E-6 808.5123134700001 808.5123134700001 808.5123134700001 808.5123134700001 808.5123134700001 0.0012454700000716912 808.5123134700001 808.5123134700001 808.5123134700001 1000000.0 1000000.0 0.004291833383467533 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.5404465452434999 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.502393810309358 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 50.94809083619776 0.0 0.0 0.0 0.95 0.96 5051285.0 5036974.5 5.0598 4.7188 0 0 14 0 0 0 0 0 13 0 0 0 -0 SM(d30:1)+H SM(d30:1)+H SM (d30:1) (d30:1) 647.5122524700001 C35 H72 O6 N2 P1 1.3847394627E7 2484787.303 6.590767773459083 1.1427529719109142 8.114741128403805 0.85 14.078616849162602 0.0 0.0 1.3625401147E7 0.0 0.0 0.0 0.0 0.0 1.3847394627E7 0.0 0.0 0.0 0.0 0.0 2215107.86 0.0 0.0 0.0 0.0 0.0 2484787.303 0.0 0.0 0.0 6.595 6.587 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6379 -6378 1574 -6377 -6376 -6375 -6374 -6373 1674 -6372 -6371 -6370 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 647.512134 647.51242 6.590767773459083 6.590767773459083 6.595 6.590767773459083 6.590767773459083 6.590767773459083 6.590767773459083 6.590767773459083 6.587 6.590767773459083 6.590767773459083 6.590767773459083 1124155.0 1413018.625 1 1 1 1 1 1 1 1 1 1 1 1 647.5122524700001 647.5122524700001 1.1847000018860854E-4 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 647.5122524700001 1.6752999988511874E-4 647.5122524700001 647.5122524700001 647.5122524700001 1000000.0 1000000.0 0.18296178911934546 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.25872869470200577 1000000.0 1000000.0 1000000.0 0.0 0.0 24.957633980231652 0.0 0.0 0.0 0.0 0.0 19.719722517231947 0.0 0.0 0.0 C C 0.0 0.0 62.394084950579135 0.0 0.0 0.0 0.0 0.0 65.73240839077316 0.0 0.0 0.0 0.91 0.85 19.901322613211665 14.078616849162602 5.2543 4.2815 0 0 24 0 0 0 0 0 22 0 0 0 -0 SM(d31:1)+H SM(d31:1)+H SM (d31:1) (d31:1) 661.5279024700002 C36 H74 O6 N2 P1 2.3351837986E7 5050797.45 6.927046747516898 1.1459477490815562 0.2053589388266601 0.91 31.181756065204148 0.0 0.0 2.2976436538E7 0.0 0.0 0.0 0.0 0.0 2.3351837986E7 0.0 0.0 0.0 0.0 0.0 5050797.45 0.0 0.0 0.0 0.0 0.0 5036150.123 0.0 0.0 0.0 6.929 6.917 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6389 -6388 1726 -6387 -6386 -6385 -6384 -6383 1827 -6382 -6381 -6380 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 661.527732 661.527972 6.927046747516898 6.927046747516898 6.929 6.927046747516898 6.927046747516898 6.927046747516898 6.927046747516898 6.927046747516898 6.917 6.927046747516898 6.927046747516898 6.927046747516898 3618851.25 4997896.0 1 1 1 1 1 1 1 1 1 1 1 1 661.5279024700002 661.5279024700002 1.70470000171008E-4 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 661.5279024700002 6.952999979148444E-5 661.5279024700002 661.5279024700002 661.5279024700002 1000000.0 1000000.0 0.257691322670609 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10510516568065333 1000000.0 1000000.0 1000000.0 0.0 0.0 24.741957078062082 0.0 0.0 0.0 0.0 0.0 18.49467966143262 0.0 0.0 0.0 C C 0.0 0.0 61.700641092424156 0.0 0.0 0.0 0.0 0.0 61.6489322047754 0.0 0.0 0.0 0.92 0.91 5.351218320626531 31.181756065204148 7.1964 8.0076 0 0 21 0 0 0 0 0 21 0 0 0 -0 SM(d32:0)+H SM(d32:0)+H SM (d32:0) (d32:0) 677.5592024700001 C37 H78 O6 N2 P1 3.371827874E7 6981310.415 7.4564103359670595 7.398748871223537 5.777700770177293 0.92 79.56923740235246 0.0 0.0 3.0365598985E7 0.0 0.0 0.0 0.0 0.0 3.371827874E7 0.0 0.0 0.0 0.0 0.0 6433264.478 0.0 0.0 0.0 0.0 0.0 6981310.415 0.0 0.0 0.0 7.463 7.441 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6399 -6398 1968 -6397 -6396 -6395 -6394 -6393 2074 -6392 -6391 -6390 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 677.558865 677.558713 7.4564103359670595 7.4564103359670595 7.463 7.4564103359670595 7.4564103359670595 7.4564103359670595 7.4564103359670595 7.4564103359670595 7.441 7.4564103359670595 7.4564103359670595 7.4564103359670595 4821526.5 6861895.5 1 1 1 1 1 1 1 1 1 1 1 1 677.5592024700001 677.5592024700001 3.3747000009043404E-4 677.5592024700001 677.5592024700001 677.5592024700001 677.5592024700001 677.5592024700001 4.894700000477314E-4 677.5592024700001 677.5592024700001 677.5592024700001 1000000.0 1000000.0 0.4980671782778658 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7224018185619779 1000000.0 1000000.0 1000000.0 0.0 0.0 25.6542425399165 0.0 0.0 0.0 0.0 0.0 25.242476843172764 0.0 0.0 0.0 C C 0.0 0.0 64.13560634979125 0.0 0.0 0.0 0.0 0.0 63.1061921079319 0.0 0.0 0.0 0.98 0.92 30.478663619636183 79.56923740235246 5.5715 5.0721 0 0 16 0 0 0 0 0 21 0 0 0 -0 SM(d32:1)+H SM(d32:1)+H SM (d32:1) (d32:1) 675.54355247 C37 H76 O6 N2 P1 8.23427811236E8 1.54875929936E8 7.239864740451241 3.0122854018348906 2.776765442964877 0.94 139.06454781909073 0.0 0.0 7.89081248384E8 0.0 0.0 0.0 0.0 0.0 8.23427811236E8 0.0 0.0 0.0 0.0 0.0 1.48911162501E8 0.0 0.0 0.0 0.0 0.0 1.54875929936E8 0.0 0.0 0.0 7.246 7.235 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6409 -6408 1921 -6407 -6406 -6405 -6404 -6403 1943 -6402 -6401 -6400 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 675.543644 675.543134 7.239864740451241 7.239864740451241 7.246 7.239864740451241 7.239864740451241 7.239864740451241 7.239864740451241 7.239864740451241 7.235 7.239864740451241 7.239864740451241 7.239864740451241 1.402455E7 9179688.0 1 1 1 1 1 1 1 1 1 1 1 1 675.54355247 675.54355247 9.152999996331346E-5 675.54355247 675.54355247 675.54355247 675.54355247 675.54355247 4.1846999999961554E-4 675.54355247 675.54355247 675.54355247 1000000.0 1000000.0 0.1354908941527914 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6194567300206736 1000000.0 1000000.0 1000000.0 0.0 0.0 26.06721560939768 0.0 0.0 0.0 0.0 0.0 25.86662741849308 0.0 0.0 0.0 C C 0.0 0.0 65.1680390234942 0.0 0.0 0.0 0.0 0.0 64.6665685462327 0.0 0.0 0.0 0.97 0.94 185.24071091264108 139.06454781909073 15.795 18.1903 0 0 26 0 0 0 0 0 26 0 0 0 -0 SM(d33:1)+H SM(d33:1)+H SM (d33:1) (d33:1) 689.5592024700001 C38 H78 O6 N2 P1 2.36989762068E8 5.0843483647E7 7.510329421595835 4.869887167115718 9.691608063265338 0.99 93.76635519161717 0.0 0.0 2.21211464281E8 0.0 0.0 0.0 0.0 0.0 2.36989762068E8 0.0 0.0 0.0 0.0 0.0 4.4321804738E7 0.0 0.0 0.0 0.0 0.0 5.0843483647E7 0.0 0.0 0.0 7.51 7.506 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6419 -6418 2038 -6417 -6416 -6415 -6414 -6413 2148 -6412 -6411 -6410 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 689.55819 689.557435 7.510329421595835 7.510329421595835 7.51 7.510329421595835 7.510329421595835 7.510329421595835 7.510329421595835 7.510329421595835 7.506 7.510329421595835 7.510329421595835 7.510329421595835 5521206.0 3150590.5 1 1 1 1 1 1 1 1 1 1 1 1 689.5592024700001 689.5592024700001 0.0010124700000915254 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 689.5592024700001 0.001767470000004323 689.5592024700001 689.5592024700001 689.5592024700001 1000000.0 1000000.0 1.46828582152897 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.5631881840939084 1000000.0 1000000.0 1000000.0 0.0 0.0 26.07951869393959 0.0 0.0 0.0 0.0 0.0 26.56863815094625 0.0 0.0 0.0 C C 0.0 0.0 65.19879673484897 0.0 0.0 0.0 0.0 0.0 66.42159537736562 0.0 0.0 0.0 0.99 0.99 73.69357436293315 93.76635519161717 8.8204 10.6114 0 0 28 0 0 0 0 0 23 0 0 0 -0 SM(d34:0)+H SM(d34:0)+H SM (d34:0) (d34:0) 705.5905024700002 C39 H82 O6 N2 P1 5.5534154254E7 1.0387270531E7 7.954387695792912 0.5992160920913471 11.405812304699497 0.73 10.853165633425904 0.0 0.0 5.5065532584E7 0.0 0.0 0.0 0.0 0.0 5.5534154254E7 0.0 0.0 0.0 0.0 0.0 8836822.935 0.0 0.0 0.0 0.0 0.0 1.0387270531E7 0.0 0.0 0.0 7.952 7.942 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6429 -6428 2204 -6427 -6426 -6425 -6424 -6423 2301 -6422 -6421 -6420 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 705.590277 705.590898 7.954387695792912 7.954387695792912 7.952 7.954387695792912 7.954387695792912 7.954387695792912 7.954387695792912 7.954387695792912 7.942 7.954387695792912 7.954387695792912 7.954387695792912 8546278.0 8613416.0 1 1 1 1 1 1 1 1 1 1 1 1 705.5905024700002 705.5905024700002 2.2547000014583318E-4 705.5905024700002 705.5905024700002 705.5905024700002 705.5905024700002 705.5905024700002 3.9552999987790827E-4 705.5905024700002 705.5905024700002 705.5905024700002 1000000.0 1000000.0 0.3195479521855094 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5605659351894765 1000000.0 1000000.0 1000000.0 0.0 0.0 23.77525742190463 0.0 0.0 0.0 0.0 0.0 18.572620753825664 0.0 0.0 0.0 C C 0.0 0.0 59.289918757866914 0.0 0.0 0.0 0.0 0.0 61.90873584608554 0.0 0.0 0.0 0.89 0.73 51.37782780727449 10.853165633425904 9.5164 6.295 0 0 33 0 0 0 0 0 22 0 0 0 -0 SM(d34:1)+H SM(d34:1)+H SM (d34:1) (d34:1) 703.5748524700001 C39 H80 O6 N2 P1 1.560898555772E9 3.39803310893E8 7.775000000000001 2.6263561250405036 2.698520395195573 0.98 493.55109999169974 0.0 0.0 1.503980255366E9 0.0 0.0 0.0 0.0 0.0 1.560898555772E9 0.0 0.0 0.0 0.0 0.0 3.2707826302E8 0.0 0.0 0.0 0.0 0.0 3.39803310893E8 0.0 0.0 0.0 7.774 7.779 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.89 0.87 -6450 -6449 2133 -6448 -6447 -6446 -6445 -6444 2241 -6443 -6442 -6441 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 703.575009 703.575371 7.775000000000001 7.775000000000001 7.774 7.775000000000001 7.775000000000001 7.775000000000001 7.775000000000001 7.775000000000001 7.779 7.775000000000001 7.775000000000001 7.775000000000001 3.12232928E8 1.28227064E8 1 1 1 1 1 1 1 1 1 1 1 1 703.5748524700001 703.5748524700001 1.5652999991289107E-4 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 703.5748524700001 5.185299999084236E-4 703.5748524700001 703.5748524700001 703.5748524700001 1000000.0 1000000.0 0.2224781050138022 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7369933676396334 1000000.0 1000000.0 1000000.0 0.0 0.0 24.831345615539927 0.0 0.0 0.0 0.0 0.0 24.527819533157768 0.0 0.0 0.0 C C 0.0 0.0 62.07836403884982 0.0 0.0 0.0 0.0 0.0 61.31954883289442 0.0 0.0 0.0 0.97 0.98 303.3029858133352 493.55109999169974 27.5414 29.8862 0 0 20 0 0 0 0 0 20 0 0 0 -0 SM(d34:2)+H SM(d34:2)+H SM (d34:2) (d34:2) 701.5592024700001 C39 H78 O6 N2 P1 1.9360261146E7 5220932.313 7.300150608325761 7.431857642407996 13.540198670275347 0.91 1.246026366642114 0.0 0.0 1.7427045181E7 0.0 0.0 0.0 0.0 0.0 1.9360261146E7 0.0 0.0 0.0 0.0 0.0 4308545.227 0.0 0.0 0.0 0.0 0.0 5220932.313 0.0 0.0 0.0 7.317 7.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 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759.637956 759.637979 8.639063773505727 8.639063773505727 8.639 8.639063773505727 8.639063773505727 8.639063773505727 8.639063773505727 8.639063773505727 8.638 8.639063773505727 8.639063773505727 8.639063773505727 7.8182104E7 4.2700212E7 1 1 1 1 1 1 1 1 1 1 1 1 759.6374524700001 759.6374524700001 5.03529999946295E-4 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 5.265299998882256E-4 759.6374524700001 759.6374524700001 759.6374524700001 1000000.0 1000000.0 0.6628556797838777 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6931332811148085 1000000.0 1000000.0 1000000.0 0.0 0.0 25.919691617769107 0.0 0.0 0.0 0.0 0.0 24.97661412077176 0.0 0.0 0.0 C C 0.0 0.0 64.79922904442277 0.0 0.0 0.0 0.0 0.0 62.4415353019294 0.0 0.0 0.0 0.81 0.84 34.12332509036594 15.480963806869571 7.4073 8.4977 0 0 29 0 0 0 0 0 30 0 0 0 -0 SM(d38:1)+H SM(d38:1)+H SM (d38:1) (d38:1) 759.6374524700001 C43 H88 O6 N2 P1 6.3904119816E7 1.2369813767E7 8.88 7.142160187901029 0.769916693106985 0.97 0.6064856932255475 0.0 0.0 5.7759765248E7 0.0 0.0 0.0 0.0 0.0 6.3904119816E7 0.0 0.0 0.0 0.0 0.0 1.2369813767E7 0.0 0.0 0.0 0.0 0.0 1.2235857218E7 0.0 0.0 0.0 8.876 8.88 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6672 -6671 -6670 -6669 -6668 -6667 -6666 -6665 2652 -6664 -6663 -6662 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 759.63745 759.637611 8.88 8.88 8.876 8.88 8.88 8.88 8.88 8.88 8.88 8.88 8.88 8.88 2.4070432E7 1 1 1 1 1 1 1 1 1 1 1 1 759.6374524700001 759.6374524700001 2.47000014041987E-6 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 759.6374524700001 1.5852999990784156E-4 759.6374524700001 759.6374524700001 759.6374524700001 1000000.0 1000000.0 0.0032515512925126826 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2086916586226405 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.932691686433717 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.3317292160843 0.0 0.0 0.0 0.66 0.97 20.352187029608405 0.6064856932255475 9.9635 7.6636 0 0 21 0 0 0 0 0 5 0 0 0 -0 SM(d38:2)+H SM(d38:2)+H SM (d38:2) (d38:2) 757.62180247 C43 H86 O6 N2 P1 2.21734031924E8 4.0636090582E7 8.23843243322317 20.43702313181678 6.379006894666747 0.86 94.58041521187518 0.0 0.0 1.6573960572E8 0.0 0.0 0.0 0.0 0.0 2.21734031924E8 0.0 0.0 0.0 0.0 0.0 3.7128414464E7 0.0 0.0 0.0 0.0 0.0 4.0636090582E7 0.0 0.0 0.0 8.237 8.233 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.74 1.0 -6682 -6681 2320 -6680 -6679 -6678 -6677 -6676 2411 -6675 -6674 -6673 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 757.62149 757.621437 8.23843243322317 8.23843243322317 8.237 8.23843243322317 8.23843243322317 8.23843243322317 8.23843243322317 8.23843243322317 8.233 8.23843243322317 8.23843243322317 8.23843243322317 4343495.5 8454979.0 1 1 1 1 1 1 1 1 1 1 1 1 757.62180247 757.62180247 3.1247000003986614E-4 757.62180247 757.62180247 757.62180247 757.62180247 757.62180247 3.6547000001974084E-4 757.62180247 757.62180247 757.62180247 1000000.0 1000000.0 0.4124353325381488 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4823910806529523 1000000.0 1000000.0 1000000.0 0.0 0.0 24.27748205890344 0.0 0.0 0.0 0.0 0.0 24.02583825462624 0.0 0.0 0.0 C C 0.0 0.0 60.69370514725861 0.0 0.0 0.0 0.0 0.0 60.0645956365656 0.0 0.0 0.0 0.89 0.86 257.8466515767422 94.58041521187518 8.7548 9.2224 0 0 27 0 0 0 0 0 27 0 0 0 -0 SM(d38:3)+H SM(d38:3)+H SM (d38:3) (d38:3) 755.60615247 C43 H84 O6 N2 P1 9213747.501 2559021.108 7.856515558537488 4.031722802046789 1.7098167662711234 0.95 7.442677152165531 0.0 0.0 8702967.308 0.0 0.0 0.0 0.0 0.0 9213747.501 0.0 0.0 0.0 0.0 0.0 2497881.985 0.0 0.0 0.0 0.0 0.0 2559021.108 0.0 0.0 0.0 7.856 7.868 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6692 -6691 2153 -6690 -6689 -6688 -6687 -6686 2257 -6685 -6684 -6683 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 755.608573 755.605981 7.856515558537488 7.856515558537488 7.856 7.856515558537488 7.856515558537488 7.856515558537488 7.856515558537488 7.856515558537488 7.868 7.856515558537488 7.856515558537488 7.856515558537488 600962.5625 2475663.25 1 1 1 1 1 1 1 1 1 1 1 1 755.60615247 755.60615247 0.0024205299999948693 755.60615247 755.60615247 755.60615247 755.60615247 755.60615247 1.7146999994110956E-4 755.60615247 755.60615247 755.60615247 1000000.0 1000000.0 3.2034281246683896 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.22693039142229257 1000000.0 1000000.0 1000000.0 0.0 0.0 24.527096340669978 0.0 0.0 0.0 0.0 0.0 18.802389017367382 0.0 0.0 0.0 C C 0.0 0.0 61.31774085167495 0.0 0.0 0.0 0.0 0.0 47.00597254341845 0.0 0.0 0.0 0.9 0.95 3.970949538912157 7.442677152165531 4.4167 4.2918 0 0 17 0 0 0 0 0 14 0 0 0 -0 SM(d38:4)+H SM(d38:4)+H SM (d38:4) (d38:4) 753.5905024700002 C43 H82 O6 N2 P1 3.7551640017E7 9807045.373 7.482938457990851 9.971454920712288 3.7531115066952494 0.99 18.118237032169855 0.0 0.0 3.2604978643E7 0.0 0.0 0.0 0.0 0.0 3.7551640017E7 0.0 0.0 0.0 0.0 0.0 9299973.635 0.0 0.0 0.0 0.0 0.0 9807045.373 0.0 0.0 0.0 7.482 7.484 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 1.0 0.96 -6702 -6701 1986 -6700 -6699 -6698 -6697 -6696 2062 -6695 -6694 -6693 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 753.589663 753.589846 7.482938457990851 7.482938457990851 7.482 7.482938457990851 7.482938457990851 7.482938457990851 7.482938457990851 7.482938457990851 7.484 7.482938457990851 7.482938457990851 7.482938457990851 9294799.0 759318.0625 1 1 1 1 1 1 1 1 1 1 1 1 753.5905024700002 753.5905024700002 8.394700001872479E-4 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 6.564700001945312E-4 753.5905024700002 753.5905024700002 753.5905024700002 1000000.0 1000000.0 1.1139604300157255 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8711229746697408 1000000.0 1000000.0 1000000.0 0.0 0.0 24.66333969895137 0.0 0.0 0.0 0.0 0.0 19.57055975860809 0.0 0.0 0.0 C C 0.0 0.0 61.65834924737842 0.0 0.0 0.0 0.0 0.0 48.926399396520225 0.0 0.0 0.0 0.99 0.99 18.308129528503912 18.118237032169855 6.6571 12.3583 0 0 13 0 0 0 0 0 13 0 0 0 -0 SM(d38:4)+H SM(d38:4)+H SM (d38:4) (d38:4) 753.5905024700002 C43 H82 O6 N2 P1 1.14683493105E8 2.3385712394E7 8.221 3.57986516041031 7.456346939911415 0.91 40.69063023378774 0.0 0.0 1.09020762302E8 0.0 0.0 0.0 0.0 0.0 1.14683493105E8 0.0 0.0 0.0 0.0 0.0 2.1043226161E7 0.0 0.0 0.0 0.0 0.0 2.3385712394E7 0.0 0.0 0.0 8.212 8.221 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6713 -6712 -6711 -6710 -6709 -6708 -6707 -6706 2476 -6705 -6704 -6703 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 753.5905 753.588659 8.221 8.221 8.212 8.221 8.221 8.221 8.221 8.221 8.221 8.221 8.221 8.221 3715720.5 1 1 1 1 1 1 1 1 1 1 1 1 753.5905024700002 753.5905024700002 2.47000014041987E-6 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 753.5905024700002 0.001843470000153502 753.5905024700002 753.5905024700002 753.5905024700002 1000000.0 1000000.0 0.003277642343320534 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.4462489828511194 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.649196120433224 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 35.379389104429315 0.0 0.0 0.0 0.88 0.91 41.74852001919179 40.69063023378774 14.8253 14.048 0 0 26 0 0 0 0 0 26 0 0 0 -0 SM(d38:5)+H SM(d38:5)+H SM (d38:5) (d38:5) 751.5748524700001 C43 H80 O6 N2 P1 1.0123248486E7 2998778.94 7.791 11.060663350278535 12.01148341466906 0.98 17.63564645393492 0.0 0.0 8654618.364 0.0 0.0 0.0 0.0 0.0 1.0123248486E7 0.0 0.0 0.0 0.0 0.0 2529260.373 0.0 0.0 0.0 0.0 0.0 2998778.94 0.0 0.0 0.0 7.796 7.79 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6724 -6723 -6722 -6721 -6720 -6719 -6718 -6717 2220 -6716 -6715 -6714 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 751.57485 751.572363 7.791 7.791 7.796 7.791 7.791 7.791 7.791 7.791 7.79 7.791 7.791 7.791 1441948.75 1 1 1 1 1 1 1 1 1 1 1 1 751.5748524700001 751.5748524700001 2.47000014041987E-6 751.5748524700001 751.5748524700001 751.5748524700001 751.5748524700001 751.5748524700001 0.0024894700001141246 751.5748524700001 751.5748524700001 751.5748524700001 1000000.0 1000000.0 0.003286432658440315 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.312338075086798 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.392281216968363 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.559073810526126 0.0 0.0 0.0 0.91 0.98 8.446001512474195 17.63564645393492 3.7027 4.9825 0 0 12 0 0 0 0 0 15 0 0 0 -0 SM(d39:1)+H SM(d39:1)+H SM (d39:1) (d39:1) 773.6531024700001 C44 H90 O6 N2 P1 1.67734443748E8 2.0373336204E7 8.844033507020926 7.031760267071581 9.66709443164331 0.72 66.37706114426877 0.0 0.0 1.51844330765E8 0.0 0.0 0.0 0.0 0.0 1.67734443748E8 0.0 0.0 0.0 0.0 0.0 1.7766241299E7 0.0 0.0 0.0 0.0 0.0 2.0373336204E7 0.0 0.0 0.0 8.831 8.842 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6745 -6744 2630 -6743 -6742 -6741 -6740 -6739 2667 -6738 -6737 -6736 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 773.653292 773.652854 8.844033507020926 8.844033507020926 8.831 8.844033507020926 8.844033507020926 8.844033507020926 8.844033507020926 8.844033507020926 8.842 8.844033507020926 8.844033507020926 8.844033507020926 1.1610541E7 5089423.0 1 1 1 1 1 1 1 1 1 1 1 1 773.6531024700001 773.6531024700001 1.8952999982957408E-4 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 2.4847000008776376E-4 773.6531024700001 773.6531024700001 773.6531024700001 1000000.0 1000000.0 0.24498059818343904 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.32116461408154007 1000000.0 1000000.0 1000000.0 0.0 0.0 26.553728742333224 0.0 0.0 0.0 0.0 0.0 25.753046398297318 0.0 0.0 0.0 C C 0.0 0.0 66.38432185583306 0.0 0.0 0.0 0.0 0.0 64.3826159957433 0.0 0.0 0.0 0.89 0.72 127.293385746518 66.37706114426877 5.1531 6.1731 0 0 35 0 0 0 0 0 35 0 0 0 -0 SM(d39:1)+H SM(d39:1)+H SM (d39:1) (d39:1) 773.6531024700001 C44 H90 O6 N2 P1 9469741.058 2793573.354 9.079 4.6875308164988745 2.088920915275409 0.78 7.854094004115734 0.0 0.0 8862116.102 0.0 0.0 0.0 0.0 0.0 9469741.058 0.0 0.0 0.0 0.0 0.0 2712247.418 0.0 0.0 0.0 0.0 0.0 2793573.354 0.0 0.0 0.0 9.084 9.105 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6756 -6755 2721 -6754 -6753 -6752 -6751 -6750 -6749 -6748 -6747 -6746 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 773.652596 773.6531 9.079 9.079 9.084 9.079 9.079 9.079 9.079 9.079 9.105 9.079 9.079 9.079 2159357.75 1 1 1 1 1 1 1 1 1 1 1 1 773.6531024700001 773.6531024700001 5.064700001184974E-4 773.6531024700001 773.6531024700001 773.6531024700001 773.6531024700001 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MS2 MS2 MS2 771.636367 771.637469 8.481533467645846 8.481533467645846 8.479 8.481533467645846 8.481533467645846 8.481533467645846 8.481533467645846 8.481533467645846 8.489 8.481533467645846 8.481533467645846 8.481533467645846 3020278.75 4258561.0 1 1 1 1 1 1 1 1 1 1 1 1 771.6374524700001 771.6374524700001 0.0010854700001345918 771.6374524700001 771.6374524700001 771.6374524700001 771.6374524700001 771.6374524700001 1.652999992529658E-5 771.6374524700001 771.6374524700001 771.6374524700001 1000000.0 1000000.0 1.4067098436707788 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.02142197721531568 1000000.0 1000000.0 1000000.0 0.0 0.0 25.4330653236767 0.0 0.0 0.0 0.0 0.0 18.783585666546504 0.0 0.0 0.0 C C 0.0 0.0 63.58266330919176 0.0 0.0 0.0 0.0 0.0 62.40393909151663 0.0 0.0 0.0 0.93 0.97 154.80982564509264 2.1479452783327098 4.9837 4.9756 0 0 28 0 0 0 0 0 27 0 0 0 -0 SM(d40:1)+H SM(d40:1)+H SM (d40:1) (d40:1) 787.6687524700002 C45 H92 O6 N2 P1 4.70468252807E8 8.7883122729E7 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0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6819 -6818 -6817 -6816 -6815 -6814 -6813 -6812 2293 -6811 -6810 -6809 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 781.6218 781.62052 7.939 7.939 7.93 7.939 7.939 7.939 7.939 7.939 7.94 7.939 7.939 7.939 2.225531E7 1 1 1 1 1 1 1 1 1 1 1 1 781.62180247 781.62180247 2.4700000267330324E-6 781.62180247 781.62180247 781.62180247 781.62180247 781.62180247 0.0012824699999782752 781.62180247 781.62180247 781.62180247 1000000.0 1000000.0 0.0031600961218425524 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6407807406670933 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.25486151811583 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.13715379528958 0.0 0.0 0.0 0.84 0.85 83.27095635075995 10.034167962740947 9.6912 6.0078 0 0 27 0 0 0 0 0 26 0 0 0 -0 SM(d41:1)+H SM(d41:1)+H SM (d41:1) (d41:1) 801.68440247 C46 H94 O6 N2 P1 1.29303623157E8 2.202892339E7 9.246743803519482 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0.0 0.0 0.0 0.0 1.8697811501E7 0.0 0.0 0.0 0.0 0.0 1.9077641324E7 0.0 0.0 0.0 9.09 9.092 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6892 -6891 2738 -6890 -6889 -6888 -6887 -6886 2778 -6885 -6884 -6883 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 809.650213 809.651362 9.090519323732252 9.090519323732252 9.09 9.090519323732252 9.090519323732252 9.090519323732252 9.090519323732252 9.090519323732252 9.092 9.090519323732252 9.090519323732252 9.090519323732252 2450538.0 1.044056E7 1 1 1 1 1 1 1 1 1 1 1 1 809.6531024700001 809.6531024700001 0.002889470000127403 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 809.6531024700001 0.0017404700001861784 809.6531024700001 809.6531024700001 809.6531024700001 1000000.0 1000000.0 3.568775307983787 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.149649022373341 1000000.0 1000000.0 1000000.0 0.0 0.0 5.983827542115989 0.0 0.0 0.0 0.0 0.0 7.250628573326082 0.0 0.0 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MS2 MS2 MS2 MS2 MS2 803.60615 803.60221 7.963 7.963 7.958 7.963 7.963 7.963 7.963 7.963 7.954 7.963 7.963 7.963 3056607.25 1 1 1 1 1 1 1 1 1 1 1 1 803.60615247 803.60615247 2.4700000267330324E-6 803.60615247 803.60615247 803.60615247 803.60615247 803.60615247 0.003942469999969944 803.60615247 803.60615247 803.60615247 1000000.0 1000000.0 0.0030736449928128714 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.905972892134027 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.059626029139289 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 30.14739317979746 0.0 0.0 0.0 0.88 0.91 10.857318926062124 8.559656378887706 5.1666 4.8456 0 0 32 0 0 0 0 0 21 0 0 0 -0 SM(t34:0)+H SM(t34:0)+H SM (t34:0) (t34:0) 721.5854174700002 C39 H82 O7 N2 P1 4414569.991 2052341.007 7.491 14.451630158879123 21.452532472317323 0.99 5.388221548484065 0.0 0.0 3595983.855 0.0 0.0 0.0 0.0 0.0 4414569.991 0.0 0.0 0.0 0.0 0.0 1511702.941 0.0 0.0 0.0 0.0 0.0 2052341.007 0.0 0.0 0.0 7.493 7.492 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6924 -6923 2003 -6922 -6921 -6920 -6919 -6918 -6917 -6916 -6915 -6914 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 721.58613 721.58542 7.491 7.491 7.493 7.491 7.491 7.491 7.491 7.491 7.492 7.491 7.491 7.491 1164383.0 1 1 1 1 1 1 1 1 1 1 1 1 721.5854174700002 721.5854174700002 7.125299998733681E-4 721.5854174700002 721.5854174700002 721.5854174700002 721.5854174700002 721.5854174700002 2.5299998469563434E-6 721.5854174700002 721.5854174700002 721.5854174700002 1000000.0 1000000.0 0.9874506643601779 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0035061682036576468 1000000.0 1000000.0 1000000.0 0.0 0.0 17.87838243742875 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 44.5844948564308 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 1523923.63 5.388221548484065 4.4209 3.2424 0 0 9 0 0 0 0 0 8 0 0 0 -0 SM(t34:1)+H SM(t34:1)+H SM (t34:1) (t34:1) 719.5697674700001 C39 H80 O7 N2 P1 6743765.023 2224113.235 7.587 4.886538381122783 12.251754499137283 0.93 12.936227966791526 0.0 0.0 6293294.914 0.0 0.0 0.0 0.0 0.0 6743765.023 0.0 0.0 0.0 0.0 0.0 1869473.582 0.0 0.0 0.0 0.0 0.0 2224113.235 0.0 0.0 0.0 7.589 7.585 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6935 -6934 -6933 -6932 -6931 -6930 -6929 -6928 2126 -6927 -6926 -6925 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 719.56977 719.570435 7.587 7.587 7.589 7.587 7.587 7.587 7.587 7.587 7.585 7.587 7.587 7.587 812759.625 1 1 1 1 1 1 1 1 1 1 1 1 719.5697674700001 719.5697674700001 2.5299998469563434E-6 719.5697674700001 719.5697674700001 719.5697674700001 719.5697674700001 719.5697674700001 6.675299998732953E-4 719.5697674700001 719.5697674700001 719.5697674700001 1000000.0 1000000.0 0.0035159896389919173 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9276793301368453 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.832854969731173 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.08213742432793 0.0 0.0 0.0 0.95 0.93 9.098444369504886 12.936227966791526 6.4038 5.9026 0 0 11 0 0 0 0 0 12 0 0 0 -0 SPH(t16:0)+H-H2O SPH(t16:0)+H-H2O SPH (t16:0) (t16:0) 272.25840547 C16 H34 O2 N1 3783937.17 434601.648 1.167 21.855421428739728 0.44510646066925275 0.65 5.215675607205479 0.0 0.0 0.0 0.0 0.0 3783937.17 0.0 0.0 0.0 0.0 0.0 2770938.963 0.0 0.0 0.0 0.0 0.0 431874.52 0.0 0.0 0.0 0.0 0.0 434601.648 1.175 1.164 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6946 -6945 -6944 -6943 -6942 -6941 -6940 -6939 -6938 -6937 -6936 190 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 272.25841 272.258331 1.167 1.167 1.167 1.167 1.167 1.175 1.167 1.167 1.167 1.167 1.167 1.164 355121.53125 1 1 1 1 1 1 1 1 1 1 1 1 272.25840547 272.25840547 272.25840547 272.25840547 272.25840547 4.530000012437085E-6 272.25840547 272.25840547 272.25840547 272.25840547 272.25840547 7.447000001548076E-5 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.016638604801262023 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2735269086988264 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.618480779912658 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.39493593304219 0.65 0.93 5.215675607205479 5.145953477032735 8.0079 7.0075 0 0 0 0 0 55 0 0 0 0 0 30 -0 StE()+H-H2O StE()+H-H2O StE () 395.36722647 C29 H47 O0 1197786.532 497595.607 9.575974446885004 8.97747765218217 4.565804606695126 1.0 56.47681777311471 0.0 0.0 0.0 1054792.048 0.0 0.0 0.0 0.0 0.0 1197786.532 0.0 0.0 0.0 0.0 0.0 466470.619 0.0 0.0 0.0 0.0 0.0 497595.607 0.0 0.0 9.579 9.575 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.95 0.95 -6956 -6955 -6954 763 -6953 -6952 -6951 -6950 -6949 809 -6948 -6947 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 395.367543 395.367217 9.575974446885004 9.575974446885004 9.575974446885004 9.579 9.575974446885004 9.575974446885004 9.575974446885004 9.575974446885004 9.575974446885004 9.575 9.575974446885004 9.575974446885004 417340.875 514548.09375 1 1 1 1 1 1 1 1 1 1 1 1 395.36722647 395.36722647 395.36722647 3.165300000205207E-4 395.36722647 395.36722647 395.36722647 395.36722647 395.36722647 9.470000009059731E-6 395.36722647 395.36722647 1000000.0 1000000.0 1000000.0 0.8005974669337915 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.023952415311738806 1000000.0 1000000.0 0.0 0.0 0.0 9.590680497485815 0.0 0.0 0.0 0.0 0.0 10.360340950532724 0.0 0.0 C C 0.0 0.0 0.0 53.28155831936563 0.0 0.0 0.0 0.0 0.0 54.52811026596168 0.0 0.0 1.0 1.0 68.30373908791746 56.47681777311471 38.559 65.6626 0 0 0 12 0 0 0 0 0 12 0 0 -0 TG(4:0_12:0_18:3)+NH4 TG(34:3)+NH4 TG (4:0_12:0_18:3) (4:0) (12:0) (18:3) 622.5041154699999 C37 H68 O6 N1 7893876.366 3202552.834 7.880119044179496 8.164679550142033 13.778762568861206 0.93 15.582765332089048 0.0 0.0 7032151.933 0.0 0.0 0.0 0.0 0.0 7893876.366 0.0 0.0 0.0 0.0 0.0 2633903.59 0.0 0.0 0.0 0.0 0.0 3202552.834 0.0 0.0 0.0 7.882 7.884 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.97 0.94 -6966 -6965 2175 -6964 -6963 -6962 -6961 -6960 2275 -6959 -6958 -6957 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 622.503666 622.504144 7.880119044179496 7.880119044179496 7.882 7.880119044179496 7.880119044179496 7.880119044179496 7.880119044179496 7.880119044179496 7.884 7.880119044179496 7.880119044179496 7.880119044179496 2952245.0 2645939.0 1 1 1 1 1 1 1 1 1 1 1 1 622.5041154699999 622.5041154699999 4.4946999992134806E-4 622.5041154699999 622.5041154699999 622.5041154699999 622.5041154699999 622.5041154699999 2.8530000122373167E-5 622.5041154699999 622.5041154699999 622.5041154699999 1000000.0 1000000.0 0.7220353869981913 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.045831022499879526 1000000.0 1000000.0 1000000.0 0.0 0.0 14.940882054564208 0.0 0.0 0.0 0.0 0.0 9.971563998064918 0.0 0.0 0.0 B C 0.0 0.0 49.64790505668899 0.0 0.0 0.0 0.0 0.0 49.347800361156544 0.0 0.0 0.0 0.96 0.93 15.241666501815926 15.582765332089048 3.573 3.5785 0 0 7 0 0 0 0 0 6 0 0 0 -0 TG(34:6)+NH4 TG(34:6)+NH4 TG (34:6) (34:6) 616.45716547 C37 H62 O6 N1 6146066.106 3003490.153 6.856 7.8526217432632635 1.5380904026080824 0.98 39.442447580218804 0.0 0.0 5499433.21 0.0 0.0 0.0 0.0 0.0 6146066.106 0.0 0.0 0.0 0.0 0.0 2938861.484 0.0 0.0 0.0 0.0 0.0 3003490.153 0.0 0.0 0.0 6.854 6.856 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6977 -6976 -6975 -6974 -6973 -6972 -6971 -6970 1795 -6969 -6968 -6967 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 616.45717 616.456396 6.856 6.856 6.854 6.856 6.856 6.856 6.856 6.856 6.856 6.856 6.856 6.856 2659648.0 1 1 1 1 1 1 1 1 1 1 1 1 616.45716547 616.45716547 4.530000069280504E-6 616.45716547 616.45716547 616.45716547 616.45716547 616.45716547 7.694699999092336E-4 616.45716547 616.45716547 616.45716547 1000000.0 1000000.0 0.00734844255695647 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2482132466131257 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.60641448780822 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 42.59187666570101 0.0 0.0 0.0 0.99 0.98 2926478.75 39.442447580218804 10.7782 9.8849 0 0 6 0 0 0 0 0 8 0 0 0 -0 TG(11:0_6:0_18:3)+Na TG(35:3)+Na TG (11:0_6:0_18:3) (11:0) (6:0) (18:3) 641.47516147 C38 H66 O6 Na1 2871411.586 876832.708 5.816506234334653 0.24470263354730784 5.8516465963175515 0.98 32.89515961188175 0.0 0.0 2861491.892 0.0 0.0 0.0 0.0 0.0 2871411.586 0.0 0.0 0.0 0.0 0.0 807153.744 0.0 0.0 0.0 0.0 0.0 876832.708 0.0 0.0 0.0 5.822 5.816 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6987 -6986 1267 -6985 -6984 -6983 -6982 -6981 1365 -6980 -6979 -6978 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 641.477893 641.477571 5.816506234334653 5.816506234334653 5.822 5.816506234334653 5.816506234334653 5.816506234334653 5.816506234334653 5.816506234334653 5.816 5.816506234334653 5.816506234334653 5.816506234334653 731597.5 879298.0625 1 1 1 1 1 1 1 1 1 1 1 1 641.47516147 641.47516147 0.0027315300000054776 641.47516147 641.47516147 641.47516147 641.47516147 641.47516147 0.0024095300000226416 641.47516147 641.47516147 641.47516147 1000000.0 1000000.0 4.258200728685928 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.7562327347187994 1000000.0 1000000.0 1000000.0 0.0 0.0 4.771688175652202 0.0 0.0 0.0 0.0 0.0 10.117583417570975 0.0 0.0 0.0 C B 0.0 0.0 24.30553403387266 0.0 0.0 0.0 0.0 0.0 33.62029223470409 0.0 0.0 0.0 0.99 0.98 39.93035524174919 32.89515961188175 17.429 18.6104 0 0 14 0 0 0 0 0 13 0 0 0 -0 TG(6:0_12:0_18:3)+NH4 TG(36:3)+NH4 TG (6:0_12:0_18:3) (6:0) (12:0) (18:3) 650.53541547 C39 H72 O6 N1 4.0436442946E7 1.5481923876E7 8.253832744922175 0.6465364400596265 3.5847522647962453 0.99 67.50969399140476 0.0 0.0 4.0068398719E7 0.0 0.0 0.0 0.0 0.0 4.0436442946E7 0.0 0.0 0.0 0.0 0.0 1.5481923876E7 0.0 0.0 0.0 0.0 0.0 1.4716454583E7 0.0 0.0 0.0 8.252 8.256 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -6997 -6996 2336 -6995 -6994 -6993 -6992 -6991 2428 -6990 -6989 -6988 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 650.535266 650.53536 8.253832744922175 8.253832744922175 8.252 8.253832744922175 8.253832744922175 8.253832744922175 8.253832744922175 8.253832744922175 8.256 8.253832744922175 8.253832744922175 8.253832744922175 6476404.5 7459626.0 1 1 1 1 1 1 1 1 1 1 1 1 650.53541547 650.53541547 1.4946999999665422E-4 650.53541547 650.53541547 650.53541547 650.53541547 650.53541547 5.5470000006607734E-5 650.53541547 650.53541547 650.53541547 1000000.0 1000000.0 0.22976458535876157 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.08526822473843591 1000000.0 1000000.0 1000000.0 0.0 0.0 14.79900506303274 0.0 0.0 0.0 0.0 0.0 9.747828408928324 0.0 0.0 0.0 B C 0.0 0.0 48.7095888791474 0.0 0.0 0.0 0.0 0.0 47.78760285022662 0.0 0.0 0.0 0.99 0.99 48.88268210115694 67.50969399140476 9.529 9.3212 0 0 14 0 0 0 0 0 14 0 0 0 -0 TG(6:0_12:1_18:3)+NH4 TG(36:4)+NH4 TG (6:0_12:1_18:3) (6:0) (12:1) (18:3) 648.5197654699999 C39 H70 O6 N1 1.7883206883E7 5450887.521 7.954722233095159 6.320256832864316 6.481669894944465 0.99 7.193210576795291 0.0 0.0 1.6353151022E7 0.0 0.0 0.0 0.0 0.0 1.7883206883E7 0.0 0.0 0.0 0.0 0.0 4973130.514 0.0 0.0 0.0 0.0 0.0 5450887.521 0.0 0.0 0.0 7.95 7.96 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7007 -7006 2196 -7005 -7004 -7003 -7002 -7001 2297 -7000 -6999 -6998 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 648.52144 648.520397 7.954722233095159 7.954722233095159 7.95 7.954722233095159 7.954722233095159 7.954722233095159 7.954722233095159 7.954722233095159 7.96 7.954722233095159 7.954722233095159 7.954722233095159 3074230.75 3535272.0 1 1 1 1 1 1 1 1 1 1 1 1 648.5197654699999 648.5197654699999 0.0016745300000593488 648.5197654699999 648.5197654699999 648.5197654699999 648.5197654699999 648.5197654699999 6.315300000778734E-4 648.5197654699999 648.5197654699999 648.5197654699999 1000000.0 1000000.0 2.5820801295790443 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9738022396590895 1000000.0 1000000.0 1000000.0 0.0 0.0 14.525392477445969 0.0 0.0 0.0 0.0 0.0 9.826297466977229 0.0 0.0 0.0 B C 0.0 0.0 47.65820066899095 0.0 0.0 0.0 0.0 0.0 48.17228834372975 0.0 0.0 0.0 0.98 0.99 5.196525237486765 7.193210576795291 5.5904 6.667 0 0 14 0 0 0 0 0 12 0 0 0 -0 TG(12:1e_6:0_18:3)+H TG(36:4e)+H TG (12:1e_6:0_18:3) (12:1e) (6:0) (18:3) 617.51395147 C39 H69 O5 7.5318684341E7 2.7867593985E7 8.086 3.5615000557252445 3.3479845047679153 1.0 188.15973113170517 0.0 0.0 7.1618281337E7 0.0 0.0 0.0 0.0 0.0 7.5318684341E7 0.0 0.0 0.0 0.0 0.0 2.7867593985E7 0.0 0.0 0.0 0.0 0.0 2.6578643267E7 0.0 0.0 0.0 8.077 8.085 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7018 -7017 -7016 -7015 -7014 -7013 -7012 -7011 2358 -7010 -7009 -7008 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 617.51395 617.513601 8.086 8.086 8.077 8.086 8.086 8.086 8.086 8.086 8.085 8.086 8.086 8.086 2.0421394E7 1 1 1 1 1 1 1 1 1 1 1 1 617.51395147 617.51395147 1.4700000292577897E-6 617.51395147 617.51395147 617.51395147 617.51395147 617.51395147 3.504700000576122E-4 617.51395147 617.51395147 617.51395147 1000000.0 1000000.0 0.0023805130649411812 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5675499302053237 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.277455616948295 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 50.227760149015644 0.0 0.0 0.0 0.99 1.0 26.095201728446668 188.15973113170517 41.4265 32.2923 0 0 10 0 0 0 0 0 11 0 0 0 -0 TG(36:4e)+H TG(36:4e)+H TG (36:4e) (36:4e) 617.51395147 C39 H69 O5 2.219325535E7 4060574.921 9.475534031156588 5.655806268938212 0.14510704402223895 0.97 15.136399900827037 0.0 0.0 2.0486385968E7 0.0 0.0 0.0 0.0 0.0 2.219325535E7 0.0 0.0 0.0 0.0 0.0 4052250.661 0.0 0.0 0.0 0.0 0.0 4060574.921 0.0 0.0 0.0 9.473 9.477 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7028 -7027 2869 -7026 -7025 -7024 -7023 -7022 2947 -7021 -7020 -7019 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 617.513683 617.513779 9.475534031156588 9.475534031156588 9.473 9.475534031156588 9.475534031156588 9.475534031156588 9.475534031156588 9.475534031156588 9.477 9.475534031156588 9.475534031156588 9.475534031156588 2606558.5 1954673.625 1 1 1 1 1 1 1 1 1 1 1 1 617.51395147 617.51395147 2.684700000372686E-4 617.51395147 617.51395147 617.51395147 617.51395147 617.51395147 1.7247000005227164E-4 617.51395147 617.51395147 617.51395147 1000000.0 1000000.0 0.43475940810433883 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.27929733351239194 1000000.0 1000000.0 1000000.0 0.0 0.0 8.63911149487822 0.0 0.0 0.0 0.0 0.0 8.602823617646038 0.0 0.0 0.0 C C 0.0 0.0 42.02151713314619 0.0 0.0 0.0 0.0 0.0 41.64947178066876 0.0 0.0 0.0 0.96 0.97 18.588099426106112 15.136399900827037 9.4282 12.3052 0 0 20 0 0 0 0 0 20 0 0 0 -0 TG(6:0_12:2_18:3)+NH4 TG(36:5)+NH4 TG (6:0_12:2_18:3) (6:0) (12:2) (18:3) 646.5041154699999 C39 H68 O6 N1 1.2951795399E7 5515903.612 7.628407352641866 4.316914539403072 16.363198880365857 1.0 23.73643713980887 0.0 0.0 1.2184504919E7 0.0 0.0 0.0 0.0 0.0 1.2951795399E7 0.0 0.0 0.0 0.0 0.0 5515903.612 0.0 0.0 0.0 0.0 0.0 4371839.445 0.0 0.0 0.0 7.634 7.631 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 1.0 0.93 -7038 -7037 2055 -7036 -7035 -7034 -7033 -7032 2154 -7031 -7030 -7029 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 646.503662 646.50449 7.628407352641866 7.628407352641866 7.634 7.628407352641866 7.628407352641866 7.628407352641866 7.628407352641866 7.628407352641866 7.631 7.628407352641866 7.628407352641866 7.628407352641866 2825478.5 4428857.0 1 1 1 1 1 1 1 1 1 1 1 1 646.5041154699999 646.5041154699999 4.5346999991124903E-4 646.5041154699999 646.5041154699999 646.5041154699999 646.5041154699999 646.5041154699999 3.7453000015830185E-4 646.5041154699999 646.5041154699999 646.5041154699999 1000000.0 1000000.0 0.7014185819707929 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.5793157246741167 1000000.0 1000000.0 1000000.0 0.0 0.0 13.670298911402206 0.0 0.0 0.0 0.0 0.0 14.462400939640272 0.0 0.0 0.0 B B 0.0 0.0 45.13739435386462 0.0 0.0 0.0 0.0 0.0 47.752803266924765 0.0 0.0 0.0 0.99 1.0 24.089122282898344 23.73643713980887 8.0266 3.6472 0 0 8 0 0 0 0 0 7 0 0 0 -0 TG(6:0_12:3_18:3)+NH4 TG(36:6)+NH4 TG (6:0_12:3_18:3) (6:0) (12:3) (18:3) 644.48846547 C39 H66 O6 N1 3.5471780784E7 1.6466602948E7 7.3 4.446713643192877 1.6075101673522176 1.0 339.80239603520516 0.0 0.0 3.3309102527E7 0.0 0.0 0.0 0.0 0.0 3.5471780784E7 0.0 0.0 0.0 0.0 0.0 1.6096464635E7 0.0 0.0 0.0 0.0 0.0 1.6466602948E7 0.0 0.0 0.0 7.302 7.296 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7049 -7048 1895 -7047 -7046 -7045 -7044 -7043 -7042 -7041 -7040 -7039 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 644.488489 644.48847 7.3 7.3 7.302 7.3 7.3 7.3 7.3 7.3 7.296 7.3 7.3 7.3 9173867.0 1 1 1 1 1 1 1 1 1 1 1 1 644.48846547 644.48846547 2.3529999907623278E-5 644.48846547 644.48846547 644.48846547 644.48846547 644.48846547 4.5299999555936665E-6 644.48846547 644.48846547 644.48846547 1000000.0 1000000.0 0.036509574908317056 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.007028830147161929 1000000.0 1000000.0 1000000.0 0.0 0.0 13.664561819838841 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 45.55228255099967 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 1.0 92.86412105485063 339.80239603520516 23.5485 13.6255 0 0 7 0 0 0 0 0 8 0 0 0 -0 TG(37:2e)+NH4 TG(37:2e)+NH4 TG (37:2e) (37:2e) 652.5874504699999 C40 H78 O5 N1 8496214.282 3103549.039 8.523 10.475126163565077 8.572751397835985 0.98 22.499047102633206 0.0 0.0 7324377.843 0.0 0.0 0.0 0.0 0.0 8496214.282 0.0 0.0 0.0 0.0 0.0 2748789.045 0.0 0.0 0.0 0.0 0.0 3103549.039 0.0 0.0 0.0 8.524 8.532 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7060 -7059 2469 -7058 -7057 -7056 -7055 -7054 -7053 -7052 -7051 -7050 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 652.586761 652.58745 8.523 8.523 8.524 8.523 8.523 8.523 8.523 8.523 8.532 8.523 8.523 8.523 2753101.75 1 1 1 1 1 1 1 1 1 1 1 1 652.5874504699999 652.5874504699999 6.894699998838405E-4 652.5874504699999 652.5874504699999 652.5874504699999 652.5874504699999 652.5874504699999 4.699999180957093E-7 652.5874504699999 652.5874504699999 652.5874504699999 1000000.0 1000000.0 1.0565174052723163 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 7.202098626892239E-4 1000000.0 1000000.0 1000000.0 0.0 0.0 6.2938861119173275 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 31.501467584141 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.96 0.98 14.46393542864131 22.499047102633206 7.1957 9.1685 0 0 16 0 0 0 0 0 17 0 0 0 -0 TG(38:4)+NH4 TG(38:4)+NH4 TG (38:4) (38:4) 676.55106547 C41 H74 O6 N1 1.5463142218E7 6306987.036 8.276164712494019 4.336763551665702 18.131082508203907 0.99 43.347270266012615 0.0 0.0 1.5463142218E7 0.0 0.0 0.0 0.0 0.0 1.4542987764E7 0.0 0.0 0.0 0.0 0.0 6306987.036 0.0 0.0 0.0 0.0 0.0 4873571.123 0.0 0.0 0.0 8.271 8.286 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7070 -7069 2346 -7068 -7067 -7066 -7065 -7064 2441 -7063 -7062 -7061 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 676.551561 676.551401 8.276164712494019 8.276164712494019 8.271 8.276164712494019 8.276164712494019 8.276164712494019 8.276164712494019 8.276164712494019 8.286 8.276164712494019 8.276164712494019 8.276164712494019 2694763.0 4385488.0 1 1 1 1 1 1 1 1 1 1 1 1 676.55106547 676.55106547 4.95529999966493E-4 676.55106547 676.55106547 676.55106547 676.55106547 676.55106547 3.355300000293937E-4 676.55106547 676.55106547 676.55106547 1000000.0 1000000.0 0.7324354734734596 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4959418692161855 1000000.0 1000000.0 1000000.0 0.0 0.0 9.293365816706908 0.0 0.0 0.0 0.0 0.0 10.15247023840687 0.0 0.0 0.0 C C 0.0 0.0 45.559652484638555 0.0 0.0 0.0 0.0 0.0 49.53873645354182 0.0 0.0 0.0 0.99 0.99 43.347270266012615 7.605575078876412 16.1415 21.3616 0 0 9 0 0 0 0 0 10 0 0 0 -0 TG(38:5)+NH4 TG(38:5)+NH4 TG (38:5) (38:5) 674.53541547 C41 H72 O6 N1 1.354373447E7 7276462.194 7.983 4.036055830973027 19.15461231475114 0.99 57.70255430229948 0.0 0.0 1.354373447E7 0.0 0.0 0.0 0.0 0.0 1.2792129341E7 0.0 0.0 0.0 0.0 0.0 7276462.194 0.0 0.0 0.0 0.0 0.0 5540488.703 0.0 0.0 0.0 7.983 7.994 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7081 -7080 2214 -7079 -7078 -7077 -7076 -7075 -7074 -7073 -7072 -7071 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 674.534657 674.53542 7.983 7.983 7.983 7.983 7.983 7.983 7.983 7.983 7.994 7.983 7.983 7.983 4661662.5 1 1 1 1 1 1 1 1 1 1 1 1 674.53541547 674.53541547 7.584699999370059E-4 674.53541547 674.53541547 674.53541547 674.53541547 674.53541547 4.530000069280504E-6 674.53541547 674.53541547 674.53541547 1000000.0 1000000.0 1.1244331765864695 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006715733474311515 1000000.0 1000000.0 1000000.0 0.0 0.0 9.572730957323323 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 46.70991245475605 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 57.70255430229948 43.159459037184185 9.8494 11.3503 0 0 8 0 0 0 0 0 8 0 0 0 -0 TG(38:6)+NH4 TG(38:6)+NH4 TG (38:6) (38:6) 672.5197654699999 C41 H70 O6 N1 4.0089355939E7 1.8739322596E7 7.687964291972733 6.41917791264943 4.725136092661005 0.99 178.88945102543644 0.0 0.0 3.6608027768E7 0.0 0.0 0.0 0.0 0.0 4.0089355939E7 0.0 0.0 0.0 0.0 0.0 1.752758158E7 0.0 0.0 0.0 0.0 0.0 1.8739322596E7 0.0 0.0 0.0 7.689 7.686 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7091 -7090 2080 -7089 -7088 -7087 -7086 -7085 2173 -7084 -7083 -7082 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 672.519444 672.51949 7.687964291972733 7.687964291972733 7.689 7.687964291972733 7.687964291972733 7.687964291972733 7.687964291972733 7.687964291972733 7.686 7.687964291972733 7.687964291972733 7.687964291972733 6773018.5 1.5114464E7 1 1 1 1 1 1 1 1 1 1 1 1 672.5197654699999 672.5197654699999 3.214699999034565E-4 672.5197654699999 672.5197654699999 672.5197654699999 672.5197654699999 672.5197654699999 2.754699999059085E-4 672.5197654699999 672.5197654699999 672.5197654699999 1000000.0 1000000.0 0.47800825553252346 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.40960877887862873 1000000.0 1000000.0 1000000.0 0.0 0.0 10.196338671010702 0.0 0.0 0.0 0.0 0.0 10.60576183588318 0.0 0.0 0.0 C C 0.0 0.0 49.98637260483292 0.0 0.0 0.0 0.0 0.0 51.993522380129384 0.0 0.0 0.0 0.99 0.99 120.87910290435063 178.88945102543644 13.2811 19.9283 0 0 8 0 0 0 0 0 7 0 0 0 -0 TG(40:3)+NH4 TG(40:3)+NH4 TG (40:3) (40:3) 706.59801547 C43 H80 O6 N1 8268287.064 3107643.274 8.803 0.45103991997453946 9.307720660867494 0.98 3821686.75 0.0 0.0 8215714.081 0.0 0.0 0.0 0.0 0.0 8268287.064 0.0 0.0 0.0 0.0 0.0 2723841.076 0.0 0.0 0.0 0.0 0.0 3107643.274 0.0 0.0 0.0 8.803 8.809 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.8 0.79 -7102 -7101 2597 -7100 -7099 -7098 -7097 -7096 -7095 -7094 -7093 -7092 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 706.597283 706.59802 8.803 8.803 8.803 8.803 8.803 8.803 8.803 8.803 8.809 8.803 8.803 8.803 2570445.75 1 1 1 1 1 1 1 1 1 1 1 1 706.59801547 706.59801547 7.324700000026496E-4 706.59801547 706.59801547 706.59801547 706.59801547 706.59801547 4.530000069280504E-6 706.59801547 706.59801547 706.59801547 1000000.0 1000000.0 1.0366148559240442 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006411000271869338 1000000.0 1000000.0 1000000.0 0.0 0.0 5.956047919182399 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 29.9007320889432 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.98 121.03974182613531 3821686.75 5.7843 9.6909 0 0 18 0 0 0 0 0 19 0 0 0 -0 TG(16:0_8:0_18:3)+NH4 TG(42:3)+NH4 TG (16:0_8:0_18:3) (16:0) (8:0) (18:3) 734.62931547 C45 H84 O6 N1 2.9848835124E7 6874286.555 9.036578856992428 7.075705875120028 1.7324444557585268 0.74 139.25672446319984 0.0 0.0 2.7004313151E7 0.0 0.0 0.0 0.0 0.0 2.9848835124E7 0.0 0.0 0.0 0.0 0.0 6707901.596 0.0 0.0 0.0 0.0 0.0 6874286.555 0.0 0.0 0.0 9.03 9.042 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7112 -7111 2687 -7110 -7109 -7108 -7107 -7106 2773 -7105 -7104 -7103 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 734.628581 734.62879 9.036578856992428 9.036578856992428 9.03 9.036578856992428 9.036578856992428 9.036578856992428 9.036578856992428 9.036578856992428 9.042 9.036578856992428 9.036578856992428 9.036578856992428 4461046.5 6300876.5 1 1 1 1 1 1 1 1 1 1 1 1 734.62931547 734.62931547 7.344699999976001E-4 734.62931547 734.62931547 734.62931547 734.62931547 734.62931547 5.25470000070527E-4 734.62931547 734.62931547 734.62931547 1000000.0 1000000.0 0.9997831348830695 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7152859122349925 1000000.0 1000000.0 1000000.0 0.0 0.0 19.133591731494846 0.0 0.0 0.0 0.0 0.0 20.210560467228525 0.0 0.0 0.0 A A 0.0 0.0 38.23828332926906 0.0 0.0 0.0 0.0 0.0 40.46917502694426 0.0 0.0 0.0 0.6 0.74 6727138.0 139.25672446319984 12.5384 12.1799 0 0 17 0 0 0 0 0 17 0 0 0 -0 TG(6:0_18:3_18:3)+NH4 TG(42:6)+NH4 TG (6:0_18:3_18:3) (6:0) (18:3) (18:3) 728.5823654699999 C45 H78 O6 N1 2.078761958E7 5826233.086 8.32704673244837 7.915970977118604 5.4989707800960606 0.72 6.38249067379162 0.0 0.0 1.8583827717E7 0.0 0.0 0.0 0.0 0.0 2.078761958E7 0.0 0.0 0.0 0.0 0.0 5390101.665 0.0 0.0 0.0 0.0 0.0 5826233.086 0.0 0.0 0.0 8.319 8.326 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7123 -7122 2376 -7121 -7120 -7119 -7118 -7117 -7116 -7115 -7114 -7113 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 728.582422 728.58237 8.32704673244837 8.32704673244837 8.319 8.32704673244837 8.32704673244837 8.32704673244837 8.32704673244837 8.32704673244837 8.326 8.32704673244837 8.32704673244837 8.32704673244837 5278029.5 1 1 1 1 1 1 1 1 1 1 1 1 728.5823654699999 728.5823654699999 5.653000005167996E-5 728.5823654699999 728.5823654699999 728.5823654699999 728.5823654699999 728.5823654699999 4.530000069280504E-6 728.5823654699999 728.5823654699999 728.5823654699999 1000000.0 1000000.0 0.07758903142709628 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006217553819544142 1000000.0 1000000.0 1000000.0 0.0 0.0 18.032052865091146 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 36.48563823990526 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.79 0.72 22.738659011073437 6.38249067379162 4.576 4.5207 0 0 13 0 0 0 0 0 13 0 0 0 -0 TG(16:0_14:0_14:0)+NH4 TG(44:0)+NH4 TG (16:0_14:0_14:0) (16:0) (14:0) (14:0) 768.7075654699998 C47 H94 O6 N1 7846035.517 2961028.296 9.827 5.178796729537346 3.4112467514390774 0.98 9.496900872151501 0.0 0.0 7291697.445 0.0 0.0 0.0 0.0 0.0 7846035.517 0.0 0.0 0.0 0.0 0.0 2821545.915 0.0 0.0 0.0 0.0 0.0 2961028.296 0.0 0.0 0.0 9.823 9.831 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.93 0.92 -7134 -7133 -7132 -7131 -7130 -7129 -7128 -7127 3109 -7126 -7125 -7124 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 768.70757 768.70762 9.827 9.827 9.823 9.827 9.827 9.827 9.827 9.827 9.831 9.827 9.827 9.827 1838911.25 1 1 1 1 1 1 1 1 1 1 1 1 768.7075654699998 768.7075654699998 4.530000182967342E-6 768.7075654699998 768.7075654699998 768.7075654699998 768.7075654699998 768.7075654699998 5.4530000170416315E-5 768.7075654699998 768.7075654699998 768.7075654699998 1000000.0 1000000.0 0.0058930084552994205 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.07093724924780181 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.37027996783634 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 49.27786110407331 0.0 0.0 0.0 0.99 0.98 3269798.25 9.496900872151501 10.1188 8.9393 0 0 11 0 0 0 0 0 10 0 0 0 -0 TG(16:1_14:0_14:1)+NH4 TG(44:2)+NH4 TG (16:1_14:0_14:1) (16:1) (14:0) (14:1) 764.67626547 C47 H90 O6 N1 2.3022371942E7 6851426.566 9.475 6.100449413617264 6.1320680476778096 0.99 7440271.5 0.0 0.0 2.1118289833E7 0.0 0.0 0.0 0.0 0.0 2.3022371942E7 0.0 0.0 0.0 0.0 0.0 6281959.417 0.0 0.0 0.0 0.0 0.0 6851426.566 0.0 0.0 0.0 9.475 9.48 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.91 0.91 -7145 -7144 2876 -7143 -7142 -7141 -7140 -7139 -7138 -7137 -7136 -7135 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 764.675643 764.67627 9.475 9.475 9.475 9.475 9.475 9.475 9.475 9.475 9.48 9.475 9.475 9.475 3668068.25 1 1 1 1 1 1 1 1 1 1 1 1 764.67626547 764.67626547 6.224699999393124E-4 764.67626547 764.67626547 764.67626547 764.67626547 764.67626547 4.530000069280504E-6 764.67626547 764.67626547 764.67626547 1000000.0 1000000.0 0.814030757913897 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005924075682532384 1000000.0 1000000.0 1000000.0 0.0 0.0 17.283650859369356 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 43.36046309489623 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 31.368644964747254 7440271.5 11.8347 10.8489 0 0 13 0 0 0 0 0 14 0 0 0 -0 TG(12:0_14:0_18:3)+NH4 TG(44:3)+NH4 TG (12:0_14:0_18:3) (12:0) (14:0) (18:3) 762.6606154699999 C47 H88 O6 N1 7.1327485409E7 1.9148604195E7 9.308 6.0261914213412755 0.5879443023650944 0.91 33.18826099726772 0.0 0.0 6.5497166933E7 0.0 0.0 0.0 0.0 0.0 7.1327485409E7 0.0 0.0 0.0 0.0 0.0 1.9148604195E7 0.0 0.0 0.0 0.0 0.0 1.8990046795E7 0.0 0.0 0.0 9.297 9.304 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.9 0.93 -7156 -7155 -7154 -7153 -7152 -7151 -7150 -7149 2871 -7148 -7147 -7146 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 762.66062 762.660657 9.308 9.308 9.297 9.308 9.308 9.308 9.308 9.308 9.304 9.308 9.308 9.308 1.0976658E7 1 1 1 1 1 1 1 1 1 1 1 1 762.6606154699999 762.6606154699999 4.530000069280504E-6 762.6606154699999 762.6606154699999 762.6606154699999 762.6606154699999 762.6606154699999 4.153000008955132E-5 762.6606154699999 762.6606154699999 762.6606154699999 1000000.0 1000000.0 0.005939732532915483 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.054454103499179514 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.202936692695967 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 44.54532875964218 0.0 0.0 0.0 0.92 0.91 384.77532465333627 33.18826099726772 26.0586 15.6925 0 0 13 0 0 0 0 0 12 0 0 0 -0 TG(14:0_12:1_18:3)+NH4 TG(44:4)+NH4 TG (14:0_12:1_18:3) (14:0) (12:1) (18:3) 760.6449654699999 C47 H86 O6 N1 1.1290924508E8 2.7635050763E7 9.116 10.2868936239444 8.266746793962456 0.99 15.497008074002931 0.0 0.0 9.7597152371E7 0.0 0.0 0.0 0.0 0.0 1.1290924508E8 0.0 0.0 0.0 0.0 0.0 2.4582677693E7 0.0 0.0 0.0 0.0 0.0 2.7635050763E7 0.0 0.0 0.0 9.102 9.113 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.76 0.77 -7167 -7166 -7165 -7164 -7163 -7162 -7161 -7160 2791 -7159 -7158 -7157 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 760.64497 760.645272 9.116 9.116 9.102 9.116 9.116 9.116 9.116 9.116 9.113 9.116 9.116 9.116 1.2965999E7 1 1 1 1 1 1 1 1 1 1 1 1 760.6449654699999 760.6449654699999 4.530000069280504E-6 760.6449654699999 760.6449654699999 760.6449654699999 760.6449654699999 760.6449654699999 3.0653000010261167E-4 760.6449654699999 760.6449654699999 760.6449654699999 1000000.0 1000000.0 0.005955472362170218 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4029869571452535 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.452097120357829 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 28.172684313547418 0.0 0.0 0.0 1.0 0.99 53.74103355250681 15.497008074002931 10.6265 13.5078 0 0 23 0 0 0 0 0 23 0 0 0 -0 TG(20:1_12:2_12:2)+NH4 TG(44:5)+NH4 TG (20:1_12:2_12:2) (20:1) (12:2) (12:2) 758.62931547 C47 H84 O6 N1 8.3583388406E7 1.340878929E7 8.918 9.048884644548496 9.15557814923365 0.88 38.87059961944009 0.0 0.0 8.3583388406E7 0.0 0.0 0.0 0.0 0.0 7.3530417992E7 0.0 0.0 0.0 0.0 0.0 1.1778191367E7 0.0 0.0 0.0 0.0 0.0 1.340878929E7 0.0 0.0 0.0 8.914 8.918 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7178 -7177 -7176 -7175 -7174 -7173 -7172 -7171 2719 -7170 -7169 -7168 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 758.62932 758.629618 8.918 8.918 8.914 8.918 8.918 8.918 8.918 8.918 8.918 8.918 8.918 8.918 1.3251079E7 1 1 1 1 1 1 1 1 1 1 1 1 758.62931547 758.62931547 4.5299999555936665E-6 758.62931547 758.62931547 758.62931547 758.62931547 758.62931547 3.0252999999902386E-4 758.62931547 758.62931547 758.62931547 1000000.0 1000000.0 0.0059712956818537355 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.39878501111124987 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.407562295401908 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.259245933538267 0.0 0.0 0.0 0.88 0.74 38.87059961944009 11.789551783575641 8.7075 7.3298 0 0 27 0 0 0 0 0 21 0 0 0 -0 TG(8:0_18:3_18:3)+NH4 TG(44:6)+NH4 TG (8:0_18:3_18:3) (8:0) (18:3) (18:3) 756.61366547 C47 H82 O6 N1 6.1815251423E7 1.28766325E7 8.664033233682694 48.53700280802439 9.745082544088177 0.73 101.15095406516343 0.0 0.0 6.1815251423E7 0.0 0.0 0.0 0.0 0.0 3.02259384075001E7 0.0 0.0 0.0 0.0 0.0 1.28766325E7 0.0 0.0 0.0 0.0 0.0 1.121642475E7 0.0 0.0 0.0 8.653 8.654 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.66 -7188 -7187 2495 -7186 -7185 -7184 -7183 -7182 2583 -7181 -7180 -7179 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 756.613383 756.61371 8.664033233682694 8.664033233682694 8.653 8.664033233682694 8.664033233682694 8.664033233682694 8.664033233682694 8.664033233682694 8.654 8.664033233682694 8.664033233682694 8.664033233682694 6671232.0 7777817.5 1 1 1 1 1 1 1 1 1 1 1 1 756.61366547 756.61366547 2.82470000001922E-4 756.61366547 756.61366547 756.61366547 756.61366547 756.61366547 4.452999996829021E-5 756.61366547 756.61366547 756.61366547 1000000.0 1000000.0 0.37333452049991034 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.05885434271218016 1000000.0 1000000.0 1000000.0 0.0 0.0 15.826723044934035 0.0 0.0 0.0 0.0 0.0 13.404649649232635 0.0 0.0 0.0 A A 0.0 0.0 26.81374997614252 0.0 0.0 0.0 0.0 0.0 27.38908854159953 0.0 0.0 0.0 0.73 0.8072078093349067 101.15095406516343 10.97189904127518 8.09 2.1695 0 0 16 0 0 0 0 0 10 0 0 0 -0 TG(18:3_12:1_14:3)+NH4 TG(44:7)+NH4 TG (18:3_12:1_14:3) (18:3) (12:1) (14:3) 754.59801547 C47 H80 O6 N1 4.2380847189E7 1.475874945E7 8.412 3.686625616537335 5.753589265258519 0.95 1.7240158E7 0.0 0.0 4.0227384438E7 0.0 0.0 0.0 0.0 0.0 4.2380847189E7 0.0 0.0 0.0 0.0 0.0 1.3604805997E7 0.0 0.0 0.0 0.0 0.0 1.475874945E7 0.0 0.0 0.0 8.412 8.417 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.81 0.8 -7199 -7198 2416 -7197 -7196 -7195 -7194 -7193 -7192 -7191 -7190 -7189 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 754.597502 754.59802 8.412 8.412 8.412 8.412 8.412 8.412 8.412 8.412 8.417 8.412 8.412 8.412 1.0921613E7 1 1 1 1 1 1 1 1 1 1 1 1 754.59801547 754.59801547 5.134699999871373E-4 754.59801547 754.59801547 754.59801547 754.59801547 754.59801547 4.530000069280504E-6 754.59801547 754.59801547 754.59801547 1000000.0 1000000.0 0.6804550097674501 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006003196372652799 1000000.0 1000000.0 1000000.0 0.0 0.0 13.179978802439045 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 44.07300541996538 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.95 1.4923523E7 1.7240158E7 4.9008 5.5153 0 0 16 0 0 0 0 0 16 0 0 0 -0 TG(20:4_12:2_12:2)+NH4 TG(44:8)+NH4 TG (20:4_12:2_12:2) (20:4) (12:2) (12:2) 752.5823654699999 C47 H78 O6 N1 1.8042125834E7 9438316.864 8.173 6.611745038644959 7.0900880577944525 0.99 45.64532382281958 0.0 0.0 1.6430460133E7 0.0 0.0 0.0 0.0 0.0 1.8042125834E7 0.0 0.0 0.0 0.0 0.0 8537127.087 0.0 0.0 0.0 0.0 0.0 9438316.864 0.0 0.0 0.0 8.171 8.177 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7210 -7209 2311 -7208 -7207 -7206 -7205 -7204 -7203 -7202 -7201 -7200 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 752.581812 752.58237 8.173 8.173 8.171 8.173 8.173 8.173 8.173 8.173 8.177 8.173 8.173 8.173 8599292.0 1 1 1 1 1 1 1 1 1 1 1 1 752.5823654699999 752.5823654699999 5.53469999886147E-4 752.5823654699999 752.5823654699999 752.5823654699999 752.5823654699999 752.5823654699999 4.530000069280504E-6 752.5823654699999 752.5823654699999 752.5823654699999 1000000.0 1000000.0 0.7354278086764576 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.006019274802501445 1000000.0 1000000.0 1000000.0 0.0 0.0 17.781129684850367 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 44.863441036227066 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 2.462086734451791 45.64532382281958 9.9765 6.8235 0 0 8 0 0 0 0 0 8 0 0 0 -0 TG(15:0_14:0_16:1)+NH4 TG(45:1)+NH4 TG (15:0_14:0_16:1) (15:0) (14:0) (16:1) 780.7075654699998 C48 H94 O6 N1 1.3809511209E7 2797608.698 9.761 5.997798710894306 5.070301024765389 0.98 17.928347857041516 0.0 0.0 1.2685821841E7 0.0 0.0 0.0 0.0 0.0 1.3809511209E7 0.0 0.0 0.0 0.0 0.0 2603949.639 0.0 0.0 0.0 0.0 0.0 2797608.698 0.0 0.0 0.0 9.754 9.76 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -7221 -7220 -7219 -7218 -7217 -7216 -7215 -7214 3079 -7213 -7212 -7211 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.70757 780.707419 9.761 9.761 9.754 9.761 9.761 9.761 9.761 9.761 9.76 9.761 9.761 9.761 2201080.0 1 1 1 1 1 1 1 1 1 1 1 1 780.7075654699998 780.7075654699998 4.530000182967342E-6 780.7075654699998 780.7075654699998 780.7075654699998 780.7075654699998 780.7075654699998 1.4646999989054166E-4 780.7075654699998 780.7075654699998 780.7075654699998 1000000.0 1000000.0 0.005802428954611451 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.18761186181456319 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 15.854522306622721 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 39.87166981204791 0.0 0.0 0.0 0.99 0.98 26.078081661376135 17.928347857041516 13.0246 11.384 0 0 16 0 0 0 0 0 17 0 0 0 -0 TG(16:0_14:0_16:1)+NH4 TG(46:1)+NH4 TG (16:0_14:0_16:1) (16:0) (14:0) (16:1) 794.7232154699999 C49 H96 O6 N1 4.7950710584E7 1.6073459225E7 9.847 7.808746660372343 6.741531001148858 0.99 139.3974846416596 0.0 0.0 4.2932487801E7 0.0 0.0 0.0 0.0 0.0 4.7950710584E7 0.0 0.0 0.0 0.0 0.0 1.4610748479E7 0.0 0.0 0.0 0.0 0.0 1.6073459225E7 0.0 0.0 0.0 9.839 9.845 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.9 0.94 -7243 -7242 -7241 -7240 -7239 -7238 -7237 -7236 3100 -7235 -7234 -7233 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 794.72322 794.723429 9.847 9.847 9.839 9.847 9.847 9.847 9.847 9.847 9.845 9.847 9.847 9.847 1081491.5 1 1 1 1 1 1 1 1 1 1 1 1 794.7232154699999 794.7232154699999 4.530000069280504E-6 794.7232154699999 794.7232154699999 794.7232154699999 794.7232154699999 794.7232154699999 2.1353000011004042E-4 794.7232154699999 794.7232154699999 794.7232154699999 1000000.0 1000000.0 0.005700097821606304 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.26868473948349253 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.281294179371233 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.362135826316916 0.0 0.0 0.0 0.99 0.99 1.6895656E7 139.3974846416596 27.4237 44.6684 0 0 13 0 0 0 0 0 12 0 0 0 -0 TG(16:0_14:1_16:1)+NH4 TG(46:2)+NH4 TG (16:0_14:1_16:1) (16:0) (14:1) (16:1) 792.7075654699998 C49 H94 O6 N1 5.9056359377E7 1.8301360342E7 9.683 1.8387628479826632 3.3222180324409405 1.0 190.82298320411553 0.0 0.0 5.7540366786E7 0.0 0.0 0.0 0.0 0.0 5.9056359377E7 0.0 0.0 0.0 0.0 0.0 1.8301360342E7 0.0 0.0 0.0 0.0 0.0 1.7461238635E7 0.0 0.0 0.0 9.683 9.682 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 1.0 0.91 -7254 -7253 2987 -7252 -7251 -7250 -7249 -7248 -7247 -7246 -7245 -7244 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 792.707302 792.70757 9.683 9.683 9.683 9.683 9.683 9.683 9.683 9.683 9.682 9.683 9.683 9.683 1598735.875 1 1 1 1 1 1 1 1 1 1 1 1 792.7075654699998 792.7075654699998 2.6346999982251873E-4 792.7075654699998 792.7075654699998 792.7075654699998 792.7075654699998 792.7075654699998 4.530000182967342E-6 792.7075654699998 792.7075654699998 792.7075654699998 1000000.0 1000000.0 0.3323672074030304 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005714591837257772 1000000.0 1000000.0 1000000.0 0.0 0.0 5.44201124741718 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 55.163838298162126 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 1.0 733.037388225602 190.82298320411553 21.045 21.44 0 0 14 0 0 0 0 0 14 0 0 0 -0 TG(14:0_14:0_18:3)+Na TG(46:3)+Na TG (14:0_14:0_18:3) (14:0) (14:0) (18:3) 795.6473114700001 C49 H88 O6 Na1 2.6861037856E7 7471864.115 9.1877200202045 4.0443818945372865 12.769091449829892 0.65 4.742282034119023 0.0 0.0 2.5367403732E7 0.0 0.0 0.0 0.0 0.0 2.6861037856E7 0.0 0.0 0.0 0.0 0.0 6234317.722 0.0 0.0 0.0 0.0 0.0 7471864.115 0.0 0.0 0.0 9.186 9.191 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7264 -7263 2737 -7262 -7261 -7260 -7259 -7258 2820 -7257 -7256 -7255 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 795.649709 795.650111 9.1877200202045 9.1877200202045 9.186 9.1877200202045 9.1877200202045 9.1877200202045 9.1877200202045 9.1877200202045 9.191 9.1877200202045 9.1877200202045 9.1877200202045 2869226.5 4368650.0 1 1 1 1 1 1 1 1 1 1 1 1 795.6473114700001 795.6473114700001 0.002397529999939252 795.6473114700001 795.6473114700001 795.6473114700001 795.6473114700001 795.6473114700001 0.002799529999947481 795.6473114700001 795.6473114700001 795.6473114700001 1000000.0 1000000.0 3.013307486089144 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.5185564754504135 1000000.0 1000000.0 1000000.0 0.0 0.0 22.708763392645615 0.0 0.0 0.0 0.0 0.0 7.267331503561405 0.0 0.0 0.0 A A 0.0 0.0 45.53685366757393 0.0 0.0 0.0 0.0 0.0 44.33519590821643 0.0 0.0 0.0 0.88 0.65 5.295067467686089 4.742282034119023 11.8219 12.5927 0 0 12 0 0 0 0 0 12 0 0 0 -0 TG(12:0_12:0_22:6)+NH4 TG(46:6)+NH4 TG (12:0_12:0_22:6) (12:0) (12:0) (22:6) 784.6449654699999 C49 H86 O6 N1 3.40323399947E8 9.4208687271E7 8.939 5.799570636314261 4.582018786044135 0.94 47.61534337908225 0.0 0.0 3.13510233652E8 0.0 0.0 0.0 0.0 0.0 3.40323399947E8 0.0 0.0 0.0 0.0 0.0 8.8295591429E7 0.0 0.0 0.0 0.0 0.0 9.4208687271E7 0.0 0.0 0.0 8.935 8.938 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7275 -7274 -7273 -7272 -7271 -7270 -7269 -7268 2707 -7267 -7266 -7265 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 784.64497 784.645009 8.939 8.939 8.935 8.939 8.939 8.939 8.939 8.939 8.938 8.939 8.939 8.939 1.8452388E7 1 1 1 1 1 1 1 1 1 1 1 1 784.6449654699999 784.6449654699999 4.530000069280504E-6 784.6449654699999 784.6449654699999 784.6449654699999 784.6449654699999 784.6449654699999 4.353000008450181E-5 784.6449654699999 784.6449654699999 784.6449654699999 1000000.0 1000000.0 0.005773311839918642 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.055477320317001554 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.326880102255274 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 37.250029622763385 0.0 0.0 0.0 0.94 0.94 53.39551281809088 47.61534337908225 27.4239 14.7337 0 0 21 0 0 0 0 0 21 0 0 0 -0 TG(22:4_12:2_12:2)+NH4 TG(46:8)+NH4 TG (22:4_12:2_12:2) (22:4) (12:2) (12:2) 780.61366547 C49 H82 O6 N1 4.0219967605E7 1.4289874622E7 8.463 4.16508503877021 1.2785946142433253 0.96 8.314666082138055 0.0 0.0 3.7918660095E7 0.0 0.0 0.0 0.0 0.0 4.0219967605E7 0.0 0.0 0.0 0.0 0.0 1.4033799457E7 0.0 0.0 0.0 0.0 0.0 1.4289874622E7 0.0 0.0 0.0 8.457 8.463 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.82 0.8 -7286 -7285 -7284 -7283 -7282 -7281 -7280 -7279 2520 -7278 -7277 -7276 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 780.61367 780.613485 8.463 8.463 8.457 8.463 8.463 8.463 8.463 8.463 8.463 8.463 8.463 8.463 1.3300462E7 1 1 1 1 1 1 1 1 1 1 1 1 780.61366547 780.61366547 4.5299999555936665E-6 780.61366547 780.61366547 780.61366547 780.61366547 780.61366547 1.8047000003207359E-4 780.61366547 780.61366547 780.61366547 1000000.0 1000000.0 0.005803126637382395 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.23118990611497214 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 13.366332729757184 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.724498438531 0.0 0.0 0.0 0.98 0.96 1.5733684E7 8.314666082138055 4.0526 5.258 0 0 8 0 0 0 0 0 7 0 0 0 -0 TG(22:3_12:3_12:3)+NH4 TG(46:9)+NH4 TG (22:3_12:3_12:3) (22:3) (12:3) (12:3) 778.59801547 C49 H80 O6 N1 1.7578268607E7 7043083.842 8.349083202531641 2.6090245286756653 1.9658977428288225 0.98 8589364.0 0.0 0.0 1.6941428883E7 0.0 0.0 0.0 0.0 0.0 1.7578268607E7 0.0 0.0 0.0 0.0 0.0 6849956.737 0.0 0.0 0.0 0.0 0.0 7043083.842 0.0 0.0 0.0 8.345 8.353 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.96 0.93 -7296 -7295 2386 -7294 -7293 -7292 -7291 -7290 2477 -7289 -7288 -7287 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 778.59758 778.59781 8.349083202531641 8.349083202531641 8.345 8.349083202531641 8.349083202531641 8.349083202531641 8.349083202531641 8.349083202531641 8.353 8.349083202531641 8.349083202531641 8.349083202531641 6627736.5 6515103.0 1 1 1 1 1 1 1 1 1 1 1 1 778.59801547 778.59801547 4.3546999995669466E-4 778.59801547 778.59801547 778.59801547 778.59801547 778.59801547 2.0546999996895465E-4 778.59801547 778.59801547 778.59801547 1000000.0 1000000.0 0.5593001668438926 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2638974103278736 1000000.0 1000000.0 1000000.0 0.0 0.0 15.613345518226415 0.0 0.0 0.0 0.0 0.0 16.933860548861347 0.0 0.0 0.0 B B 0.0 0.0 39.393920321721424 0.0 0.0 0.0 0.0 0.0 42.51829602163693 0.0 0.0 0.0 0.98 0.98 7772165.0 8589364.0 17.7792 12.5243 0 0 8 0 0 0 0 0 9 0 0 0 -0 TG(15:0_16:0_16:0)+NH4 TG(47:0)+NH4 TG (15:0_16:0_16:0) (15:0) (16:0) (16:0) 810.75451547 C50 H100 O6 N1 9046503.26 2349641.67 10.073 2.6857558643930495 9.677612114788998 1.0 57.53183638823029 0.0 0.0 9046503.26 0.0 0.0 0.0 0.0 0.0 8709299.928 0.0 0.0 0.0 0.0 0.0 2048661.181 0.0 0.0 0.0 0.0 0.0 2349641.67 0.0 0.0 0.0 10.073 10.091 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 1.0 -7307 -7306 3108 -7305 -7304 -7303 -7302 -7301 -7300 -7299 -7298 -7297 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 810.75443 810.75452 10.073 10.073 10.073 10.073 10.073 10.073 10.073 10.073 10.091 10.073 10.073 10.073 1494226.375 1 1 1 1 1 1 1 1 1 1 1 1 810.75451547 810.75451547 8.547000004455185E-5 810.75451547 810.75451547 810.75451547 810.75451547 810.75451547 4.5299999555936665E-6 810.75451547 810.75451547 810.75451547 1000000.0 1000000.0 0.10542031948475095 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005587387882715145 1000000.0 1000000.0 1000000.0 0.0 0.0 25.952320512972605 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 52.68383122585496 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.97 57.53183638823029 54.51519987001394 9.0815 11.3002 0 0 13 0 0 0 0 0 13 0 0 0 -0 TG(15:0_16:0_16:1)+NH4 TG(47:1)+NH4 TG (15:0_16:0_16:1) (15:0) (16:0) (16:1) 808.73886547 C50 H98 O6 N1 3.0732736535E7 7298027.636 9.924 6.264403823328039 15.097384940362362 0.97 99.09441212363608 0.0 0.0 2.8125548514E7 0.0 0.0 0.0 0.0 0.0 3.0732736535E7 0.0 0.0 0.0 0.0 0.0 5890130.643 0.0 0.0 0.0 0.0 0.0 7298027.636 0.0 0.0 0.0 9.925 9.931 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7318 -7317 3045 -7316 -7315 -7314 -7313 -7312 -7311 -7310 -7309 -7308 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 808.73858 808.73887 9.924 9.924 9.925 9.924 9.924 9.924 9.924 9.924 9.931 9.924 9.924 9.924 1423085.5 1 1 1 1 1 1 1 1 1 1 1 1 808.73886547 808.73886547 2.8546999999434775E-4 808.73886547 808.73886547 808.73886547 808.73886547 808.73886547 4.530000069280504E-6 808.73886547 808.73886547 808.73886547 1000000.0 1000000.0 0.3529816757705176 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00560131367823888 1000000.0 1000000.0 1000000.0 0.0 0.0 5.327386364598227 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 53.485982447417335 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.97 59.95016316302803 99.09441212363608 14.6741 9.8905 0 0 16 0 0 0 0 0 15 0 0 0 -0 TG(15:0_16:1_16:1)+NH4 TG(47:2)+NH4 TG (15:0_16:1_16:1) (15:0) (16:1) (16:1) 806.7232154699999 C50 H96 O6 N1 5.2707875967E7 1.1634553583E7 9.774 3.256885942743701 6.771973213880081 0.99 1.2177165E7 0.0 0.0 5.0334837178E7 0.0 0.0 0.0 0.0 0.0 5.2707875967E7 0.0 0.0 0.0 0.0 0.0 1.0571227919E7 0.0 0.0 0.0 0.0 0.0 1.1634553583E7 0.0 0.0 0.0 9.768 9.778 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.96 0.95 -7329 -7328 -7327 -7326 -7325 -7324 -7323 -7322 3095 -7321 -7320 -7319 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 806.72322 806.72394 9.774 9.774 9.768 9.774 9.774 9.774 9.774 9.774 9.778 9.774 9.774 9.774 1.0842168E7 1 1 1 1 1 1 1 1 1 1 1 1 806.7232154699999 806.7232154699999 4.530000069280504E-6 806.7232154699999 806.7232154699999 806.7232154699999 806.7232154699999 806.7232154699999 7.245300000704447E-4 806.7232154699999 806.7232154699999 806.7232154699999 1000000.0 1000000.0 0.005615308921835489 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.8981147265587626 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.178469257107197 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 52.32415687325993 0.0 0.0 0.0 0.99 0.99 367.86399794553785 1.2177165E7 17.8728 19.1003 0 0 16 0 0 0 0 0 16 0 0 0 -0 TG(16:0_16:0_16:0)+Na TG(48:0)+Na TG (16:0_16:0_16:0) (16:0) (16:0) (16:0) 829.7255614700001 C51 H98 O6 Na1 8853606.308 3356647.823 9.871 4.672621865730757 3.0079054441152735 0.99 17.347693146843934 0.0 0.0 8287264.629 0.0 0.0 0.0 0.0 0.0 8853606.308 0.0 0.0 0.0 0.0 0.0 3216835.722 0.0 0.0 0.0 0.0 0.0 3356647.823 0.0 0.0 0.0 9.87 9.881 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7340 -7339 3034 -7338 -7337 -7336 -7335 -7334 -7333 -7332 -7331 -7330 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 829.727839 829.72556 9.871 9.871 9.87 9.871 9.871 9.871 9.871 9.871 9.881 9.871 9.871 9.871 1915706.375 1 1 1 1 1 1 1 1 1 1 1 1 829.7255614700001 829.7255614700001 0.0022775299999011622 829.7255614700001 829.7255614700001 829.7255614700001 829.7255614700001 829.7255614700001 1.4700001429446274E-6 829.7255614700001 829.7255614700001 829.7255614700001 1000000.0 1000000.0 2.744919652548886 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.001771670310289431 1000000.0 1000000.0 1000000.0 0.0 0.0 83.99361955629001 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 55.33176518859685 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 4.2595893980792585 17.347693146843934 11.9927 9.0135 0 0 10 0 0 0 0 0 11 0 0 0 -0 TG(16:0_14:0_18:3)+H TG(48:3)+H TG (16:0_14:0_18:3) (16:0) (14:0) (18:3) 801.69666647 C51 H93 O6 9016571.25 2728670.702 9.687 11.74840306999278 10.511477769027143 0.87 5.548687253908561 0.0 0.0 7633395.957 0.0 0.0 0.0 0.0 0.0 9016571.25 0.0 0.0 0.0 0.0 0.0 2728670.702 0.0 0.0 0.0 0.0 0.0 2351104.37 0.0 0.0 0.0 9.688 9.722 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7351 -7350 2974 -7349 -7348 -7347 -7346 -7345 -7344 -7343 -7342 -7341 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 801.696793 801.69667 9.687 9.687 9.688 9.687 9.687 9.687 9.687 9.687 9.722 9.687 9.687 9.687 2573956.25 1 1 1 1 1 1 1 1 1 1 1 1 801.69666647 801.69666647 1.265299999886338E-4 801.69666647 801.69666647 801.69666647 801.69666647 801.69666647 3.5300000718052615E-6 801.69666647 801.69666647 801.69666647 1000000.0 1000000.0 0.15782777362136957 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004403161718693958 1000000.0 1000000.0 1000000.0 0.0 0.0 38.374410261228476 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 48.348416838470044 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.79 0.87 3.2375334503917523 5.548687253908561 5.4883 11.6468 0 0 12 0 0 0 0 0 13 0 0 0 -0 TG(16:1_14:0_18:3)+NH4 TG(48:4)+NH4 TG (16:1_14:0_18:3) (16:1) (14:0) (18:3) 816.7075654699998 C51 H94 O6 N1 6.00062524776E8 1.46238843236E8 9.526 4.825656524660001 3.9061472139404128 1.0 292.5804866936235 0.0 0.0 5.60462459336E8 0.0 0.0 0.0 0.0 0.0 6.00062524776E8 0.0 0.0 0.0 0.0 0.0 1.38377558393E8 0.0 0.0 0.0 0.0 0.0 1.46238843236E8 0.0 0.0 0.0 9.524 9.532 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.034 0.0 0.0 0.0 0.0 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.97 0.94 -7362 -7361 2882 -7360 -7359 -7358 -7357 -7356 -7355 -7354 -7353 -7352 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 816.706075 816.70757 9.526 9.526 9.524 9.526 9.526 9.526 9.526 9.526 9.532 9.526 9.526 9.526 6540939.0 1 1 1 1 1 1 1 1 1 1 1 1 816.7075654699998 816.7075654699998 0.0014904699997941862 816.7075654699998 816.7075654699998 816.7075654699998 816.7075654699998 816.7075654699998 4.530000182967342E-6 816.7075654699998 816.7075654699998 816.7075654699998 1000000.0 1000000.0 1.8249739108715721 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005546661221829643 1000000.0 1000000.0 1000000.0 0.0 0.0 15.652797387035159 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 38.98585937101721 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 233.69136260312447 292.5804866936235 26.1268 29.0644 0 0 14 0 0 0 0 0 15 0 0 0 -0 TG(16:1_14:1_18:3)+NH4 TG(48:5)+NH4 TG (16:1_14:1_18:3) (16:1) (14:1) (18:3) 814.69191547 C51 H92 O6 N1 6.79620466018E8 1.5602459434E8 9.364 4.4611539733173515 4.805431894111926 0.96 102.63001593251191 0.0 0.0 6.38054255813E8 0.0 0.0 0.0 0.0 0.0 6.79620466018E8 0.0 0.0 0.0 0.0 0.0 1.45769762493E8 0.0 0.0 0.0 0.0 0.0 1.5602459434E8 0.0 0.0 0.0 9.357 9.364 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.81 0.8 -7373 -7372 2804 -7371 -7370 -7369 -7368 -7367 -7366 -7365 -7364 -7363 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 814.691209 814.69192 9.364 9.364 9.357 9.364 9.364 9.364 9.364 9.364 9.364 9.364 9.364 9.364 9831919.0 1 1 1 1 1 1 1 1 1 1 1 1 814.69191547 814.69191547 7.064700000682933E-4 814.69191547 814.69191547 814.69191547 814.69191547 814.69191547 4.5299999555936665E-6 814.69191547 814.69191547 814.69191547 1000000.0 1000000.0 0.8671621586679512 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005560384078416056 1000000.0 1000000.0 1000000.0 0.0 0.0 14.631911777736443 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 47.8511410178036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.96 157.49548588480752 102.63001593251191 30.5248 20.2648 0 0 15 0 0 0 0 0 15 0 0 0 -0 TG(12:0_18:3_18:3)+NH4 TG(48:6)+NH4 TG (12:0_18:3_18:3) (12:0) (18:3) (18:3) 812.67626547 C51 H90 O6 N1 1.968728314147E9 3.8305230556E8 9.179 54.46882990511581 10.723337756415702 0.91 225.11202764568813 0.0 0.0 1.968728314147E9 0.0 0.0 0.0 0.0 0.0 8.73887068810781E8 0.0 0.0 0.0 0.0 0.0 3.29056347593E8 0.0 0.0 0.0 0.0 0.0 3.8305230556E8 0.0 0.0 0.0 9.175 9.19 0.0 0.0 0.058 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.74 0.74 -7384 -7383 2723 -7382 -7381 -7380 -7379 -7378 -7377 -7376 -7375 -7374 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 812.675701 812.67627 9.179 9.179 9.175 9.179 9.179 9.179 9.179 9.179 9.19 9.179 9.179 9.179 3.9921516E7 1 1 1 1 1 1 1 1 1 1 1 1 812.67626547 812.67626547 5.644699999720615E-4 812.67626547 812.67626547 812.67626547 812.67626547 812.67626547 4.530000069280504E-6 812.67626547 812.67626547 812.67626547 1000000.0 1000000.0 0.6945816236501113 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005574175427235643 1000000.0 1000000.0 1000000.0 0.0 0.0 33.45338880615739 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 56.30774495671416 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.91 0.7284290320089224 225.11202764568813 3.8382256E8 53.6807 47.4961 0 0 14 0 0 0 0 0 18 0 0 0 -0 TG(12:0_18:3_18:3)+H TG(48:6)+H TG (12:0_18:3_18:3) (12:0) (18:3) (18:3) 795.64971647 C51 H87 O6 8.1473735967E7 2.3830123635E7 9.509 1.1885788899302105 9.40435534968915 0.95 992.0053828982326 0.0 0.0 8.0115654392E7 0.0 0.0 0.0 0.0 0.0 8.1473735967E7 0.0 0.0 0.0 0.0 0.0 2.0858389594E7 0.0 0.0 0.0 0.0 0.0 2.3830123635E7 0.0 0.0 0.0 9.509 9.515 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.83 1.0 -7395 -7394 2883 -7393 -7392 -7391 -7390 -7389 -7388 -7387 -7386 -7385 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 795.6469 795.64972 9.509 9.509 9.509 9.509 9.509 9.509 9.509 9.509 9.515 9.509 9.509 9.509 8922911.0 1 1 1 1 1 1 1 1 1 1 1 1 795.64971647 795.64971647 0.002816470000084337 795.64971647 795.64971647 795.64971647 795.64971647 795.64971647 3.529999958118424E-6 795.64971647 795.64971647 795.64971647 1000000.0 1000000.0 3.539836616268727 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004436625672135865 1000000.0 1000000.0 1000000.0 0.0 0.0 5.207310447680161 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 39.86476841383815 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.92 0.95 2.3237588E7 992.0053828982326 24.0216 39.0907 0 0 12 0 0 0 0 0 11 0 0 0 -0 TG(18:3_12:1_18:3)+NH4 TG(48:7)+NH4 TG (18:3_12:1_18:3) (18:3) (12:1) (18:3) 810.6606154699999 C51 H88 O6 N1 5.92083409092E8 1.61106900099E8 8.956117497526536 1.447742202118773 2.404026321870139 0.99 191.731091360349 0.0 0.0 5.80083835386E8 0.0 0.0 0.0 0.0 0.0 5.92083409092E8 0.0 0.0 0.0 0.0 0.0 1.55721129916E8 0.0 0.0 0.0 0.0 0.0 1.61106900099E8 0.0 0.0 0.0 8.958 8.962 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.94 0.95 -7406 -7405 -7404 -7403 -7402 -7401 -7400 -7399 2710 -7398 -7397 -7396 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 810.66062 810.660237 8.956117497526536 8.956117497526536 8.958 8.956117497526536 8.956117497526536 8.956117497526536 8.956117497526536 8.956117497526536 8.962 8.956117497526536 8.956117497526536 8.956117497526536 5577859.5 1 1 1 1 1 1 1 1 1 1 1 1 810.6606154699999 810.6606154699999 4.530000069280504E-6 810.6606154699999 810.6606154699999 810.6606154699999 810.6606154699999 810.6606154699999 3.7846999987323215E-4 810.6606154699999 810.6606154699999 810.6606154699999 1000000.0 1000000.0 0.005588035218232636 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4668661492254747 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 32.62699999055002 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.006378918645304 0.0 0.0 0.0 0.99 0.99 109.45781024324091 191.731091360349 15.8809 16.5217 0 0 17 0 0 0 0 0 17 0 0 0 -0 TG(18:3_12:1_18:3)+Na TG(48:7)+Na TG (18:3_12:1_18:3) (18:3) (12:1) (18:3) 815.61601147 C51 H84 O6 Na1 2.77260251848E8 8.345875331E7 8.956117497526536 6.222493638625157 1.0540609782584416 0.99 9.2019112E7 0.0 0.0 2.53889821521E8 0.0 0.0 0.0 0.0 0.0 2.77260251848E8 0.0 0.0 0.0 0.0 0.0 8.2223864978E7 0.0 0.0 0.0 0.0 0.0 8.345875331E7 0.0 0.0 0.0 8.947 8.952 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.95 0.94 -7417 -7416 2633 -7415 -7414 -7413 -7412 -7411 -7410 -7409 -7408 -7407 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 815.614879 815.61601 8.956117497526536 8.956117497526536 8.947 8.956117497526536 8.956117497526536 8.956117497526536 8.956117497526536 8.956117497526536 8.952 8.956117497526536 8.956117497526536 8.956117497526536 1.4704874E7 1 1 1 1 1 1 1 1 1 1 1 1 815.61601147 815.61601147 0.0011324700000159282 815.61601147 815.61601147 815.61601147 815.61601147 815.61601147 1.4700000292577897E-6 815.61601147 815.61601147 815.61601147 1000000.0 1000000.0 1.388484267216452 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0018023187487557794 1000000.0 1000000.0 1000000.0 0.0 0.0 7.408656609724276 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 45.730144436694545 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 141.738141102189 9.2019112E7 20.5963 20.5191 0 0 12 0 0 0 0 0 12 0 0 0 -0 TG(15:0_16:0_18:1)+NH4 TG(49:1)+NH4 TG (15:0_16:0_18:1) (15:0) (16:0) (18:1) 836.77016547 C52 H102 O6 N1 2.9250908968E7 6884426.377 10.093022679661946 0.3130362094320132 5.650302120701442 0.98 7392391.0 0.0 0.0 2.912170118E7 0.0 0.0 0.0 0.0 0.0 2.9250908968E7 0.0 0.0 0.0 0.0 0.0 6355444.935 0.0 0.0 0.0 0.0 0.0 6884426.377 0.0 0.0 0.0 10.088 10.093 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.87 0.94 -7427 -7426 3107 -7425 -7424 -7423 -7422 -7421 3200 -7420 -7419 -7418 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 836.770185 836.770304 10.093022679661946 10.093022679661946 10.088 10.093022679661946 10.093022679661946 10.093022679661946 10.093022679661946 10.093022679661946 10.093 10.093022679661946 10.093022679661946 10.093022679661946 2885404.5 2835436.25 1 1 1 1 1 1 1 1 1 1 1 1 836.77016547 836.77016547 1.9529999917722307E-5 836.77016547 836.77016547 836.77016547 836.77016547 836.77016547 1.385299999583367E-4 836.77016547 836.77016547 836.77016547 1000000.0 1000000.0 0.02333974217012461 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1655532255748228 1000000.0 1000000.0 1000000.0 0.0 0.0 6.677137793295331 0.0 0.0 0.0 0.0 0.0 5.780617730512021 0.0 0.0 0.0 A A 0.0 0.0 67.03723934581095 0.0 0.0 0.0 0.0 0.0 58.22176189556845 0.0 0.0 0.0 0.97 0.98 192.57139244555177 7392391.0 22.4246 18.9837 0 0 15 0 0 0 0 0 15 0 0 0 -0 TG(15:0_16:0_18:2)+NH4 TG(49:2)+NH4 TG (15:0_16:0_18:2) (15:0) (16:0) (18:2) 834.75451547 C52 H100 O6 N1 6.1646793853E7 1.3375761322E7 9.939 3.1435645188143853 6.125232142872737 0.98 201.27922228398322 0.0 0.0 5.8965774518E7 0.0 0.0 0.0 0.0 0.0 6.1646793853E7 0.0 0.0 0.0 0.0 0.0 1.226520168E7 0.0 0.0 0.0 0.0 0.0 1.3375761322E7 0.0 0.0 0.0 9.94 9.943 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.95 0.94 -7438 -7437 3050 -7436 -7435 -7434 -7433 -7432 -7431 -7430 -7429 -7428 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 834.754245 834.75452 9.939 9.939 9.94 9.939 9.939 9.939 9.939 9.939 9.943 9.939 9.939 9.939 1912125.875 1 1 1 1 1 1 1 1 1 1 1 1 834.75451547 834.75451547 2.704700000322191E-4 834.75451547 834.75451547 834.75451547 834.75451547 834.75451547 4.5299999555936665E-6 834.75451547 834.75451547 834.75451547 1000000.0 1000000.0 0.32401142493962276 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005426745074919537 1000000.0 1000000.0 1000000.0 0.0 0.0 6.133606265454038 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 61.580282450226406 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 312.15467298130636 201.27922228398322 35.1074 21.8199 0 0 15 0 0 0 0 0 15 0 0 0 -0 TG(15:0_16:0_18:3)+H TG(49:3)+H TG (15:0_16:0_18:3) (15:0) (16:0) (18:3) 815.71231647 C52 H95 O6 4000198.948 1213741.807 9.777327178098707 9.377243566457393 2.3272528694324714 0.92 1.580503625689792 0.0 0.0 3502703.084 0.0 0.0 0.0 0.0 0.0 4000198.948 0.0 0.0 0.0 0.0 0.0 1213741.807 0.0 0.0 0.0 0.0 0.0 1174441.474 0.0 0.0 0.0 9.787 9.793 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7449 -7448 -7447 -7446 -7445 -7444 -7443 -7442 3091 -7441 -7440 -7439 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 815.71232 815.711496 9.777327178098707 9.777327178098707 9.787 9.777327178098707 9.777327178098707 9.777327178098707 9.777327178098707 9.777327178098707 9.793 9.777327178098707 9.777327178098707 9.777327178098707 1027582.375 1 1 1 1 1 1 1 1 1 1 1 1 815.71231647 815.71231647 3.529999958118424E-6 815.71231647 815.71231647 815.71231647 815.71231647 815.71231647 8.204700000078446E-4 815.71231647 815.71231647 815.71231647 1000000.0 1000000.0 0.004327506017555945 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.005832550816976 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 32.91313600150855 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 41.46768661797406 0.0 0.0 0.0 0.87 0.92 1.6908583337566314 1.580503625689792 3.4514 3.3008 0 0 14 0 0 0 0 0 15 0 0 0 -0 TG(15:0_16:0_18:3)+NH4 TG(49:3)+NH4 TG (15:0_16:0_18:3) (15:0) (16:0) (18:3) 832.73886547 C52 H98 O6 N1 2.86957107569E8 6.1633172516E7 9.777327178098707 7.980828324638345 4.7775588875339325 0.98 333.4777134034786 0.0 0.0 2.56299518207E8 0.0 0.0 0.0 0.0 0.0 2.86957107569E8 0.0 0.0 0.0 0.0 0.0 5.760501525E7 0.0 0.0 0.0 0.0 0.0 6.1633172516E7 0.0 0.0 0.0 9.779 9.783 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.88 0.92 -7460 -7459 -7458 -7457 -7456 -7455 -7454 -7453 3083 -7452 -7451 -7450 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 832.73887 832.739069 9.777327178098707 9.777327178098707 9.779 9.777327178098707 9.777327178098707 9.777327178098707 9.777327178098707 9.777327178098707 9.783 9.777327178098707 9.777327178098707 9.777327178098707 5.0840012E7 1 1 1 1 1 1 1 1 1 1 1 1 832.73886547 832.73886547 4.530000069280504E-6 832.73886547 832.73886547 832.73886547 832.73886547 832.73886547 2.0353000002160115E-4 832.73886547 832.73886547 832.73886547 1000000.0 1000000.0 0.005439880684233178 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2444103529462724 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 31.88250883603283 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.93254948843865 0.0 0.0 0.0 0.97 0.98 368.5586767856816 333.4777134034786 23.9728 22.824 0 0 13 0 0 0 0 0 14 0 0 0 -0 TG(15:0_16:1_18:3)+NH4 TG(49:4)+NH4 TG (15:0_16:1_18:3) (15:0) (16:1) (18:3) 830.7232154699999 C52 H96 O6 N1 2.87547651029E8 6.9241558723E7 9.63997172204419 8.295844122994543 14.188463822029373 0.97 670.8925277322741 0.0 0.0 2.55681566369E8 0.0 0.0 0.0 0.0 0.0 2.87547651029E8 0.0 0.0 0.0 0.0 0.0 5.661470329E7 0.0 0.0 0.0 0.0 0.0 6.9241558723E7 0.0 0.0 0.0 9.639 9.645 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7471 -7470 2916 -7469 -7468 -7467 -7466 -7465 -7464 -7463 -7462 -7461 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 830.721269 830.72322 9.63997172204419 9.63997172204419 9.639 9.63997172204419 9.63997172204419 9.63997172204419 9.63997172204419 9.63997172204419 9.645 9.63997172204419 9.63997172204419 9.63997172204419 3586751.75 1 1 1 1 1 1 1 1 1 1 1 1 830.7232154699999 830.7232154699999 0.001946469999893452 830.7232154699999 830.7232154699999 830.7232154699999 830.7232154699999 830.7232154699999 4.530000069280504E-6 830.7232154699999 830.7232154699999 830.7232154699999 1000000.0 1000000.0 2.3431029296469026 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005453079900647241 1000000.0 1000000.0 1000000.0 0.0 0.0 26.093020567927965 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 64.83309888426211 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.95 0.97 330.26270635953614 670.8925277322741 15.1958 15.7779 0 0 17 0 0 0 0 0 16 0 0 0 -0 TG(18:3_13:0_18:2)+NH4 TG(49:5)+NH4 TG (18:3_13:0_18:2) (18:3) (13:0) (18:2) 828.7075654699998 C52 H94 O6 N1 2.90944131874E8 7.5600081172E7 9.444 7.635897210702513 11.56380571073918 0.99 134.7897258530324 0.0 0.0 2.61135190227E8 0.0 0.0 0.0 0.0 0.0 2.90944131874E8 0.0 0.0 0.0 0.0 0.0 6.4171199583E7 0.0 0.0 0.0 0.0 0.0 7.5600081172E7 0.0 0.0 0.0 9.445 9.45 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7482 -7481 2843 -7480 -7479 -7478 -7477 -7476 -7475 -7474 -7473 -7472 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 828.706571 828.70757 9.444 9.444 9.445 9.444 9.444 9.444 9.444 9.444 9.45 9.444 9.444 9.444 1720247.375 1 1 1 1 1 1 1 1 1 1 1 1 828.7075654699998 828.7075654699998 9.944699997959106E-4 828.7075654699998 828.7075654699998 828.7075654699998 828.7075654699998 828.7075654699998 4.530000182967342E-6 828.7075654699998 828.7075654699998 828.7075654699998 1000000.0 1000000.0 1.2000252456147167 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005466343462664253 1000000.0 1000000.0 1000000.0 0.0 0.0 17.181658847513464 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 56.366902963649444 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 133.3430500543858 134.7897258530324 35.5938 25.4319 0 0 15 0 0 0 0 0 15 0 0 0 -0 TG(18:3_13:0_18:3)+NH4 TG(49:6)+NH4 TG (18:3_13:0_18:3) (18:3) (13:0) (18:3) 826.69191547 C52 H92 O6 N1 5.08251877952E8 1.53653660993E8 9.26711374647243 3.619174993778882 5.301487966455615 0.98 92.63980898444969 0.0 0.0 4.82887209585E8 0.0 0.0 0.0 0.0 0.0 5.08251877952E8 0.0 0.0 0.0 0.0 0.0 1.42549827242E8 0.0 0.0 0.0 0.0 0.0 1.53653660993E8 0.0 0.0 0.0 9.263 9.27 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7492 -7491 2761 -7490 -7489 -7488 -7487 -7486 2852 -7485 -7484 -7483 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 826.691162 826.691762 9.26711374647243 9.26711374647243 9.263 9.26711374647243 9.26711374647243 9.26711374647243 9.26711374647243 9.26711374647243 9.27 9.26711374647243 9.26711374647243 9.26711374647243 2532297.0 2.0477688E7 1 1 1 1 1 1 1 1 1 1 1 1 826.69191547 826.69191547 7.534700000633165E-4 826.69191547 826.69191547 826.69191547 826.69191547 826.69191547 1.534699999865552E-4 826.69191547 826.69191547 826.69191547 1000000.0 1000000.0 0.9114278075828834 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.18564352343920373 1000000.0 1000000.0 1000000.0 0.0 0.0 29.066104741465338 0.0 0.0 0.0 0.0 0.0 31.288986435800183 0.0 0.0 0.0 A A 0.0 0.0 57.86359390268046 0.0 0.0 0.0 0.0 0.0 51.864473475097796 0.0 0.0 0.0 0.97 0.98 95.12955325180413 92.63980898444969 51.2125 24.0569 0 0 13 0 0 0 0 0 13 0 0 0 -0 TG(18:0_16:0_16:0)+NH4 TG(50:0)+NH4 TG (18:0_16:0_16:0) (18:0) (16:0) (16:0) 852.8014654699999 C53 H106 O6 N1 1.68983257E7 6446460.533 10.336972621812937 22.667951609762483 18.971045813141107 0.99 188.53404989904192 0.0 1.0520576259E7 1.5149723192E7 0.0 0.0 0.0 0.0 1.1304731381E7 1.68983257E7 0.0 0.0 0.0 0.0 4413830.927 6103093.175 0.0 0.0 0.0 0.0 4634579.393 6446460.533 0.0 0.0 0.0 10.338 10.325 10.336 10.331 0.0 0.018 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.019 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.9 0.91 1.0 0.93 -7502 1086 -7501 -7500 -7499 -7498 -7497 1125 -7496 -7495 -7494 -7493 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 852.80168 852.80147 852.801721 852.80147 10.336972621812937 10.338 10.325 10.336972621812937 10.336972621812937 10.336972621812937 10.336972621812937 10.336 10.331 10.336972621812937 10.336972621812937 10.336972621812937 4433421.5 4153319.25 1 1 1 1 1 1 1 1 1 1 1 1 852.8014654699999 2.1453000010751566E-4 4.530000069280504E-6 852.8014654699999 852.8014654699999 852.8014654699999 852.8014654699999 2.5553000011768745E-4 4.530000069280504E-6 852.8014654699999 852.8014654699999 852.8014654699999 1000000.0 0.25155913632170285 0.005311904649206846 1000000.0 1000000.0 1000000.0 1000000.0 0.29963597679426895 0.005311904649206846 1000000.0 1000000.0 1000000.0 0.0 6.857353220610034 0.0 0.0 0.0 0.0 0.0 33.80873901242293 0.0 0.0 0.0 0.0 A A 0.0 70.18773613014068 0.0 0.0 0.0 0.0 0.0 68.36287262012755 0.0 0.0 0.0 0.0 0.99 1.0 0.99 0.99 48.96855081444989 426.80768589645635 51.63158184658732 188.53404989904192 33.9206 40.9575 32.9974 25.0518 0 8 9 0 0 0 0 8 9 0 0 0 -0 TG(16:0_16:0_18:1)+NH4 TG(50:1)+NH4 TG (16:0_16:0_18:1) (16:0) (16:0) (18:1) 850.7858154699999 C53 H104 O6 N1 5.4252737737E7 2.2310182859E7 10.182886778102912 47.10782847622326 50.196688714126466 0.98 77.69940882535785 0.0 2.2351290409E7 4.8177087227E7 0.0 0.0 0.0 0.0 2.1178519194E7 5.4252737737E7 0.0 0.0 0.0 0.0 8244660.658 1.9292268109E7 0.0 0.0 0.0 0.0 8400061.331 2.2310182859E7 0.0 0.0 0.0 10.188 10.171 10.185 10.179 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.92 1.0 0.92 1.0 -7511 1037 -7510 -7509 -7508 -7507 -7506 1073 3271 -7505 -7504 -7503 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 850.78633 850.78582 850.786373 850.785663 10.182886778102912 10.188 10.171 10.182886778102912 10.182886778102912 10.182886778102912 10.182886778102912 10.185 10.179 10.182886778102912 10.182886778102912 10.182886778102912 6099141.5 3187500.75 476417.46875 1 1 1 1 1 1 1 1 1 1 1 1 850.7858154699999 5.145300001458963E-4 4.530000069280504E-6 850.7858154699999 850.7858154699999 850.7858154699999 850.7858154699999 5.575300001510186E-4 1.5246999987539311E-4 850.7858154699999 850.7858154699999 850.7858154699999 1000000.0 0.6047703085666213 0.005324489415444703 1000000.0 1000000.0 1000000.0 1000000.0 0.6553118188072072 0.17921079207363613 1000000.0 1000000.0 1000000.0 0.0 42.13881037371336 0.0 0.0 0.0 0.0 0.0 60.50658787828793 6.264408739974874 0.0 0.0 0.0 A A A 0.0 70.81145904086895 0.0 0.0 0.0 0.0 0.0 75.56650806284122 63.50020517314754 0.0 0.0 0.0 1.0 0.98 0.99 0.98 175.08235382661888 96.74262778622574 221.3308413259606 77.69940882535785 44.9689 26.3874 25.1992 24.181 0 10 9 0 0 0 0 9 8 0 0 0 -0 TG(16:0_16:0_18:3)+H TG(50:3)+H TG (16:0_16:0_18:3) (16:0) (16:0) (18:3) 829.7279664700001 C53 H97 O6 9020478.043 3355785.576 9.883 3.747230596826423 3.0266569850850495 0.99 19.648938946393752 0.0 0.0 8554787.606 0.0 0.0 0.0 0.0 0.0 9020478.043 0.0 0.0 0.0 0.0 0.0 3215156.271 0.0 0.0 0.0 0.0 0.0 3355785.576 0.0 0.0 0.0 9.869 9.881 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7522 -7521 -7520 -7519 -7518 -7517 -7516 -7515 3131 -7514 -7513 -7512 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 829.72797 829.728526 9.883 9.883 9.869 9.883 9.883 9.883 9.883 9.883 9.881 9.883 9.883 9.883 3329653.75 1 1 1 1 1 1 1 1 1 1 1 1 829.7279664700001 829.7279664700001 3.529999958118424E-6 829.7279664700001 829.7279664700001 829.7279664700001 829.7279664700001 829.7279664700001 5.595299999185954E-4 829.7279664700001 829.7279664700001 829.7279664700001 1000000.0 1000000.0 0.004254406384705193 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.674353550235342 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 57.70172206913412 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 58.151271305336095 0.0 0.0 0.0 0.99 0.99 12.076677649967062 19.648938946393752 10.9169 10.2261 0 0 10 0 0 0 0 0 11 0 0 0 -0 TG(16:1_16:1_18:3)+NH4 TG(50:5)+NH4 TG (16:1_16:1_18:3) (16:1) (16:1) (18:3) 842.7232154699999 C53 H96 O6 N1 1.157261043224E9 3.61806989727E8 9.551 4.784436302270557 3.606874079489466 1.0 406.73845873387563 0.0 0.0 1.081520654964E9 0.0 0.0 0.0 0.0 0.0 1.157261043224E9 0.0 0.0 0.0 0.0 0.0 3.43810600332E8 0.0 0.0 0.0 0.0 0.0 3.61806989727E8 0.0 0.0 0.0 9.547 9.552 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.91 0.92 -7533 -7532 -7531 -7530 -7529 -7528 -7527 -7526 2969 -7525 -7524 -7523 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 842.72322 842.720121 9.551 9.551 9.547 9.551 9.551 9.551 9.551 9.551 9.552 9.551 9.551 9.551 7821550.5 1 1 1 1 1 1 1 1 1 1 1 1 842.7232154699999 842.7232154699999 4.530000069280504E-6 842.7232154699999 842.7232154699999 842.7232154699999 842.7232154699999 842.7232154699999 0.0030944699999508885 842.7232154699999 842.7232154699999 842.7232154699999 1000000.0 1000000.0 0.005375430492625093 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.671988552285289 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.31840469696649 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.78957381947575 0.0 0.0 0.0 0.99 1.0 374.4973884666525 406.73845873387563 30.8283 27.2559 0 0 13 0 0 0 0 0 13 0 0 0 -0 TG(14:0_18:3_18:3)+H TG(50:6)+H TG (14:0_18:3_18:3) (14:0) (18:3) (18:3) 823.6810164699999 C53 H91 O6 5.3543308352E7 2.1068192242E7 9.38 1.8284056641429944 4.5155502602783235 0.99 19.536390685985108 0.0 0.0 5.2176480415E7 0.0 0.0 0.0 0.0 0.0 5.3543308352E7 0.0 0.0 0.0 0.0 0.0 2.1068192242E7 0.0 0.0 0.0 0.0 0.0 1.9764416751E7 0.0 0.0 0.0 9.381 9.385 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7555 -7554 2820 -7553 -7552 -7551 -7550 -7549 -7548 -7547 -7546 -7545 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 823.680794 823.68102 9.38 9.38 9.381 9.38 9.38 9.38 9.38 9.38 9.385 9.38 9.38 9.38 3345664.0 1 1 1 1 1 1 1 1 1 1 1 1 823.6810164699999 823.6810164699999 2.2246999992603378E-4 823.6810164699999 823.6810164699999 823.6810164699999 823.6810164699999 823.6810164699999 3.5300000718052615E-6 823.6810164699999 823.6810164699999 823.6810164699999 1000000.0 1000000.0 0.270092421067879 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004285639709087348 1000000.0 1000000.0 1000000.0 0.0 0.0 51.24324376355199 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 50.80711278304951 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 22.01944611692721 19.536390685985108 13.2424 11.3965 0 0 11 0 0 0 0 0 12 0 0 0 -0 TG(18:3_14:2_18:3)+NH4 TG(50:8)+NH4 TG (18:3_14:2_18:3) (18:3) (14:2) (18:3) 836.67626547 C53 H90 O6 N1 1.322366280188E9 5.20282530422E8 8.980416690020252 3.540359197692048 2.2911185299602286 0.99 1993.951614996884 0.0 0.0 1.257774720841E9 0.0 0.0 0.0 0.0 0.0 1.322366280188E9 0.0 0.0 0.0 0.0 0.0 5.20282530422E8 0.0 0.0 0.0 0.0 0.0 5.03693449367E8 0.0 0.0 0.0 8.98 8.985 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.92 0.97 -7565 -7564 2656 -7563 -7562 -7561 -7560 -7559 2817 -7558 -7557 -7556 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 836.674673 836.672932 8.980416690020252 8.980416690020252 8.98 8.980416690020252 8.980416690020252 8.980416690020252 8.980416690020252 8.980416690020252 8.985 8.980416690020252 8.980416690020252 8.980416690020252 3.6773552E7 920952.5 1 1 1 1 1 1 1 1 1 1 1 1 836.67626547 836.67626547 0.0015924699999914083 836.67626547 836.67626547 836.67626547 836.67626547 836.67626547 0.0033334700000295925 836.67626547 836.67626547 836.67626547 1000000.0 1000000.0 1.9033287613302186 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.9841813824574395 1000000.0 1000000.0 1000000.0 0.0 0.0 20.22193148071619 0.0 0.0 0.0 0.0 0.0 14.766121444048478 0.0 0.0 0.0 B B 0.0 0.0 50.40708996754009 0.0 0.0 0.0 0.0 0.0 48.75564543370381 0.0 0.0 0.0 0.99 0.99 1632.3060824880172 1993.951614996884 83.6052 98.9943 0 0 9 0 0 0 0 0 9 0 0 0 -0 TG(18:3_14:3_18:3)+NH4 TG(50:9)+NH4 TG (18:3_14:3_18:3) (18:3) (14:3) (18:3) 834.6606154699999 C53 H88 O6 N1 1.931343709536E9 7.71121320748E8 8.78002690457985 5.09737527090747 4.397971132142878 1.0 934.8952236527006 0.0 0.0 1.79696111472E9 0.0 0.0 0.0 0.0 0.0 1.931343709536E9 0.0 0.0 0.0 0.0 0.0 7.24606645784E8 0.0 0.0 0.0 0.0 0.0 7.71121320748E8 0.0 0.0 0.0 8.775 8.783 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.98 0.93 -7576 -7575 -7574 -7573 -7572 -7571 -7570 -7569 2650 -7568 -7567 -7566 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 834.66062 834.659764 8.78002690457985 8.78002690457985 8.775 8.78002690457985 8.78002690457985 8.78002690457985 8.78002690457985 8.78002690457985 8.783 8.78002690457985 8.78002690457985 8.78002690457985 7.8688808E7 1 1 1 1 1 1 1 1 1 1 1 1 834.6606154699999 834.6606154699999 4.530000069280504E-6 834.6606154699999 834.6606154699999 834.6606154699999 834.6606154699999 834.6606154699999 8.514699999295772E-4 834.6606154699999 834.6606154699999 834.6606154699999 1000000.0 1000000.0 0.005427355724373849 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.0201391848950627 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 30.394945221089543 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 50.71073991002842 0.0 0.0 0.0 0.99 1.0 5431.839109149856 934.8952236527006 145.6516 132.3853 0 0 8 0 0 0 0 0 8 0 0 0 -0 TG(18:3_14:3_18:3)+H TG(50:9)+H TG (18:3_14:3_18:3) (18:3) (14:3) (18:3) 817.63406647 C53 H85 O6 2.5171683652E7 1.0163941843E7 8.78002690457985 0.20465747309212518 0.931046377742719 0.99 30.522693281159047 0.0 0.0 2.5171683652E7 0.0 0.0 0.0 0.0 0.0 2.5098934684E7 0.0 0.0 0.0 0.0 0.0 1.0163941843E7 0.0 0.0 0.0 0.0 0.0 1.0030988678E7 0.0 0.0 0.0 8.777 8.782 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.96 0.96 -7587 -7586 2580 -7585 -7584 -7583 -7582 -7581 -7580 -7579 -7578 -7577 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 817.63482 817.63407 8.78002690457985 8.78002690457985 8.777 8.78002690457985 8.78002690457985 8.78002690457985 8.78002690457985 8.78002690457985 8.782 8.78002690457985 8.78002690457985 8.78002690457985 1.1391045E7 1 1 1 1 1 1 1 1 1 1 1 1 817.63406647 817.63406647 7.535299999972267E-4 817.63406647 817.63406647 817.63406647 817.63406647 817.63406647 3.529999958118424E-6 817.63406647 817.63406647 817.63406647 1000000.0 1000000.0 0.9215980973621464 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0043173347379697816 1000000.0 1000000.0 1000000.0 0.0 0.0 5.34767100568076 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 0.0 40.74105085613285 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 30.522693281159047 123.10805929340218 30.0361 42.9103 0 0 8 0 0 0 0 0 8 0 0 0 -0 TG(18:0_16:0_17:0)+NH4 TG(51:0)+NH4 TG (18:0_16:0_17:0) (18:0) (16:0) (17:0) 866.81711547 C54 H108 O6 N1 1472931.095 414494.986 10.4 1.6673707697766307 9.019503583744818 0.99 37.1793722217677 0.0 1472931.095 0.0 0.0 0.0 0.0 0.0 1438603.831 0.0 0.0 0.0 0.0 0.0 414494.986 0.0 0.0 0.0 0.0 0.0 364793.874 0.0 0.0 0.0 0.0 10.401 10.409 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7598 1102 -7597 -7596 -7595 -7594 -7593 -7592 -7591 -7590 -7589 -7588 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 866.817571 866.81712 10.4 10.401 10.4 10.4 10.4 10.4 10.4 10.409 10.4 10.4 10.4 10.4 343335.90625 1 1 1 1 1 1 1 1 1 1 1 1 866.81711547 4.5553000006748334E-4 866.81711547 866.81711547 866.81711547 866.81711547 866.81711547 4.530000069280504E-6 866.81711547 866.81711547 866.81711547 866.81711547 1000000.0 0.5255203109602754 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005226015947809564 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.463015130358956 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 65.30343249427041 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.93 37.1793722217677 21.73939136250833 5.1855 6.6544 0 17 0 0 0 0 0 15 0 0 0 0 -0 TG(18:0_16:0_17:1)+NH4 TG(51:1)+NH4 TG (18:0_16:0_17:1) (18:0) (16:0) (17:1) 864.8014654699999 C54 H106 O6 N1 6279597.927 1816042.037 10.262950400638905 0.8265965550913082 2.9310849375662595 0.99 20.738833382163186 0.0 6206616.996 0.0 0.0 0.0 0.0 0.0 6279597.927 0.0 0.0 0.0 0.0 0.0 1742292.353 0.0 0.0 0.0 0.0 0.0 1816042.037 0.0 0.0 0.0 0.0 10.262 10.261 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7608 1062 -7607 -7606 -7605 -7604 -7603 1114 -7602 -7601 -7600 -7599 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 864.801722 864.801308 10.262950400638905 10.262 10.262950400638905 10.262950400638905 10.262950400638905 10.262950400638905 10.262950400638905 10.261 10.262950400638905 10.262950400638905 10.262950400638905 10.262950400638905 1050886.75 683358.9375 1 1 1 1 1 1 1 1 1 1 1 1 864.8014654699999 2.565300001151627E-4 864.8014654699999 864.8014654699999 864.8014654699999 864.8014654699999 864.8014654699999 1.5746999997645617E-4 864.8014654699999 864.8014654699999 864.8014654699999 864.8014654699999 1000000.0 0.2966345575926429 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.18208803553642777 1000000.0 1000000.0 1000000.0 1000000.0 0.0 3.64462277759935 0.0 0.0 0.0 0.0 0.0 5.933792214404295 0.0 0.0 0.0 0.0 B A 0.0 53.81652207016606 0.0 0.0 0.0 0.0 0.0 59.95607181672443 0.0 0.0 0.0 0.0 0.99 0.99 36.20367646717084 20.738833382163186 14.0798 11.3659 0 13 0 0 0 0 0 14 0 0 0 0 -0 TG(16:0_17:1_18:1)+NH4 TG(51:2)+NH4 TG (16:0_17:1_18:1) (16:0) (17:1) (18:1) 862.7858154699999 C54 H104 O6 N1 2.5080911022E7 6132781.134 10.113 2.5277600847016863 3.755974593144482 0.99 28.132646101165086 0.0 2.4200064687E7 0.0 0.0 0.0 0.0 0.0 2.5080911022E7 0.0 0.0 0.0 0.0 0.0 5815451.011 0.0 0.0 0.0 0.0 0.0 6132781.134 0.0 0.0 0.0 0.0 10.114 10.114 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.93 0.93 -7619 -7618 -7617 -7616 -7615 -7614 -7613 1064 -7612 -7611 -7610 -7609 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 862.78582 862.785907 10.113 10.114 10.113 10.113 10.113 10.113 10.113 10.114 10.113 10.113 10.113 10.113 4397565.0 1 1 1 1 1 1 1 1 1 1 1 1 862.7858154699999 4.530000069280504E-6 862.7858154699999 862.7858154699999 862.7858154699999 862.7858154699999 862.7858154699999 9.15300000770003E-5 862.7858154699999 862.7858154699999 862.7858154699999 862.7858154699999 1000000.0 0.005250434103176349 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10608658422037179 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.291156931084774 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 53.63467881384643 0.0 0.0 0.0 0.0 1.0 0.99 124.16269934278019 28.132646101165086 21.0521 4.7664 0 14 0 0 0 0 0 14 0 0 0 0 -0 TG(16:0_17:0_18:3)+NH4 TG(51:3)+NH4 TG (16:0_17:0_18:3) (16:0) (17:0) (18:3) 860.77016547 C54 H102 O6 N1 8.1965902085E7 1.9312367989E7 9.963 2.2817129124699367 0.6577915657848826 0.98 460.0976636629672 0.0 7.936299794E7 0.0 0.0 0.0 0.0 0.0 8.1965902085E7 0.0 0.0 0.0 0.0 0.0 1.9133544946E7 0.0 0.0 0.0 0.0 0.0 1.9312367989E7 0.0 0.0 0.0 0.0 9.966 9.963 0.0 0.033 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.037 0.0 0.0 0.0 0.0 0.94 0.92 -7630 -7629 -7628 -7627 -7626 -7625 -7624 1008 -7623 -7622 -7621 -7620 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 860.77017 860.770381 9.963 9.966 9.963 9.963 9.963 9.963 9.963 9.963 9.963 9.963 9.963 9.963 1.8752188E7 1 1 1 1 1 1 1 1 1 1 1 1 860.77016547 4.5299999555936665E-6 860.77016547 860.77016547 860.77016547 860.77016547 860.77016547 2.1552999999130407E-4 860.77016547 860.77016547 860.77016547 860.77016547 1000000.0 0.005262728818116255 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.25039204265823944 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 24.90153366365982 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 62.320974176925446 0.0 0.0 0.0 0.0 0.99 0.98 935.7904796223288 460.0976636629672 15.7225 15.9563 0 15 0 0 0 0 0 15 0 0 0 0 -0 TG(15:0_18:1_18:3)+NH4 TG(51:4)+NH4 TG (15:0_18:1_18:3) (15:0) (18:1) (18:3) 858.75451547 C54 H100 O6 N1 2.5165244611E8 5.9428413402E7 9.798601447365012 6.133553282674623 12.652318490373846 0.94 178.88014397461387 0.0 2.20597304469E8 2.31849296204E8 0.0 0.0 0.0 0.0 2.22519882395E8 2.5165244611E8 0.0 0.0 0.0 0.0 4.4126048551E7 5.4638140922E7 0.0 0.0 0.0 0.0 4.964917345E7 5.9428413402E7 0.0 0.0 0.0 9.802 9.788 9.805 9.803 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.047 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.93 1.0 1.0 1.0 -7639 -7638 2990 -7637 -7636 -7635 -7634 954 3076 -7633 -7632 -7631 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 858.75452 858.75255 858.754452 858.752711 9.798601447365012 9.802 9.788 9.798601447365012 9.798601447365012 9.798601447365012 9.798601447365012 9.805 9.803 9.798601447365012 9.798601447365012 9.798601447365012 5124515.0 4.0796728E7 3110312.5 1 1 1 1 1 1 1 1 1 1 1 1 858.75451547 4.5299999555936665E-6 0.0019654699999591685 858.75451547 858.75451547 858.75451547 858.75451547 6.346999998640968E-5 0.001804470000024594 858.75451547 858.75451547 858.75451547 1000000.0 0.005275081381219147 2.28874487941814 1000000.0 1000000.0 1000000.0 1000000.0 0.07390936390206027 2.101264060354896 1000000.0 1000000.0 1000000.0 0.0 0.0 26.469210560348404 0.0 0.0 0.0 0.0 17.217474842958374 30.8530374100596 0.0 0.0 0.0 A B A 0.0 0.0 65.76781485224944 0.0 0.0 0.0 0.0 57.02406238424427 61.302371976142126 0.0 0.0 0.0 0.88 0.92 0.87 0.94 443.27612289444863 220.8035080767965 408.02941310694496 178.88014397461387 16.9084 23.1091 48.485 15.4959 0 16 15 0 0 0 0 15 14 0 0 0 -0 TG(15:0_18:2_18:3)+NH4 TG(51:5)+NH4 TG (15:0_18:2_18:3) (15:0) (18:2) (18:3) 856.73886547 C54 H98 O6 N1 2.37943608109E8 5.6551740229E7 9.633081386302097 15.453735557986908 15.177449612994884 1.0 629.3026489678632 0.0 1.73205460253E8 2.16642872793E8 0.0 0.0 0.0 0.0 1.7805180356E8 2.37943608109E8 0.0 0.0 0.0 0.0 4.2069179664E7 5.4915349508E7 0.0 0.0 0.0 0.0 4.3679894E7 5.6551740229E7 0.0 0.0 0.0 9.635 9.627 9.641 9.639 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7649 -7648 2926 -7647 -7646 -7645 -7644 -7643 3004 -7642 -7641 -7640 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 856.73887 856.737908 856.73887 856.738296 9.633081386302097 9.635 9.627 9.633081386302097 9.633081386302097 9.633081386302097 9.633081386302097 9.641 9.639 9.633081386302097 9.633081386302097 9.633081386302097 5384870.5 1966265.125 1 1 1 1 1 1 1 1 1 1 1 1 856.73886547 4.530000069280504E-6 9.574700000030134E-4 856.73886547 856.73886547 856.73886547 856.73886547 4.530000069280504E-6 5.694699999594377E-4 856.73886547 856.73886547 856.73886547 1000000.0 0.005287492200783238 1.1175750728639504 1000000.0 1000000.0 1000000.0 1000000.0 0.005287492200783238 0.6646949530497034 1000000.0 1000000.0 1000000.0 0.0 0.0 23.421412095557958 0.0 0.0 0.0 0.0 0.0 23.498858774930515 0.0 0.0 0.0 A A 0.0 0.0 58.194976792636766 0.0 0.0 0.0 0.0 0.0 58.527762222082934 0.0 0.0 0.0 1.0 0.99 1.0 1.0 82.96160898410827 499.8190637269015 1181.7377005126373 629.3026489678632 21.2632 40.5959 23.1756 14.2892 0 15 14 0 0 0 0 15 15 0 0 0 -0 TG(51:5)+NH4 TG(51:5)+NH4 TG (51:5) (51:5) 856.73886547 C54 H98 O6 N1 3874679.387 1728939.583 9.9 16.789979822866265 17.320240378625947 0.98 15.181640302105011 0.0 2576644.397 3874679.387 0.0 0.0 0.0 0.0 3582036.461 3624651.684 0.0 0.0 0.0 0.0 1226262.286 1728939.583 0.0 0.0 0.0 0.0 1209718.386 1458376.121 0.0 0.0 0.0 9.894 9.879 9.898 9.883 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7660 -7659 -7658 -7657 -7656 -7655 -7654 965 -7653 -7652 -7651 -7650 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 856.73887 856.73887 856.740481 856.73887 9.9 9.894 9.879 9.9 9.9 9.9 9.9 9.898 9.883 9.9 9.9 9.9 72804.117188 1 1 1 1 1 1 1 1 1 1 1 1 856.73886547 4.530000069280504E-6 4.530000069280504E-6 856.73886547 856.73886547 856.73886547 856.73886547 0.0016155300000946227 4.530000069280504E-6 856.73886547 856.73886547 856.73886547 1000000.0 0.005287492200783238 0.005287492200783238 1000000.0 1000000.0 1000000.0 1000000.0 1.8856737626912212 0.005287492200783238 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 13.452076523851574 0.0 0.0 0.0 0.0 C 0.0 0.0 0.0 0.0 0.0 0.0 0.0 65.03131732698321 0.0 0.0 0.0 0.0 0.96 0.98 0.98 0.97 1.7664236976153633 15.181640302105011 -2.21912586758902 15.215672717891348 7.1701 6.0458 8.8198 5.7343 0 10 10 0 0 0 0 11 8 0 0 0 -0 TG(15:0_18:3_18:3)+NH4 TG(51:6)+NH4 TG (15:0_18:3_18:3) (15:0) (18:3) (18:3) 854.7232154699999 C54 H96 O6 N1 5.38233920503E8 1.34207808322E8 9.460664439979643 19.90873303860016 15.928323055219519 0.99 302.77328903093724 0.0 3.60988697438E8 5.04375830306E8 0.0 0.0 0.0 0.0 3.79092971735E8 5.38233920503E8 0.0 0.0 0.0 0.0 9.6681522415E7 1.28334242801E8 0.0 0.0 0.0 0.0 1.03297639549E8 1.34207808322E8 0.0 0.0 0.0 9.462 9.454 9.464 9.465 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7670 -7669 2845 -7668 -7667 -7666 -7665 -7664 2936 -7663 -7662 -7661 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 854.72322 854.721633 854.72322 854.721945 9.460664439979643 9.462 9.454 9.460664439979643 9.460664439979643 9.460664439979643 9.460664439979643 9.464 9.465 9.460664439979643 9.460664439979643 9.460664439979643 2267274.75 1.2687679E7 1 1 1 1 1 1 1 1 1 1 1 1 854.7232154699999 4.530000069280504E-6 0.001582469999902969 854.7232154699999 854.7232154699999 854.7232154699999 854.7232154699999 4.530000069280504E-6 0.0012704699998948854 854.7232154699999 854.7232154699999 854.7232154699999 1000000.0 0.005299961422937978 1.8514414622899786 1000000.0 1000000.0 1000000.0 1000000.0 0.005299961422937978 1.4864110122436214 1000000.0 1000000.0 1000000.0 0.0 0.0 30.2196375322677 0.0 0.0 0.0 0.0 0.0 30.27237088201543 0.0 0.0 0.0 A A 0.0 0.0 60.62908287780344 0.0 0.0 0.0 0.0 0.0 60.38177102040054 0.0 0.0 0.0 1.0 0.99 0.99 0.99 12.751995785570607 586.1115992081976 566.1007357812679 302.77328903093724 21.6148 52.7934 27.881 25.6818 0 14 14 0 0 0 0 14 14 0 0 0 -0 TG(15:0_18:3_18:3)+Na TG(51:6)+Na TG (15:0_18:3_18:3) (15:0) (18:3) (18:3) 859.67861147 C54 H92 O6 Na1 1.69715164009E8 4.4024875411E7 9.460664439979643 71.22218956977454 76.57756505149945 0.98 264.7754531148393 0.0 1.51276087807E8 3.9116464337E7 0.0 0.0 0.0 0.0 1.69715164009E8 3.7824993129E7 0.0 0.0 0.0 0.0 3.8323754776E7 8908184.83 0.0 0.0 0.0 0.0 4.4024875411E7 8072837.903 0.0 0.0 0.0 9.46 9.459 9.465 9.461 0.0 0.028 0.037 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.033 0.032 0.0 0.0 0.0 0.0 0.0 0.035 0.0 0.0 0.0 0.91 0.93 1.0 0.93 -7681 -7680 -7679 -7678 -7677 -7676 -7675 803 -7674 -7673 -7672 -7671 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 859.67861 859.67861 859.67819 859.67861 9.460664439979643 9.46 9.459 9.460664439979643 9.460664439979643 9.460664439979643 9.460664439979643 9.465 9.461 9.460664439979643 9.460664439979643 9.460664439979643 7092001.5 1 1 1 1 1 1 1 1 1 1 1 1 859.67861147 1.469999915570952E-6 1.469999915570952E-6 859.67861147 859.67861147 859.67861147 859.67861147 4.2146999999204127E-4 1.469999915570952E-6 859.67861147 859.67861147 859.67861147 1000000.0 0.0017099412454351266 0.0017099412454351266 1000000.0 1000000.0 1000000.0 1000000.0 0.4902646109472845 0.0017099412454351266 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.591106343882654 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 64.737973337572 0.0 0.0 0.0 0.0 0.98 0.98 0.98 0.99 3053.9726278874728 1.0360316E7 264.7754531148393 494.22290421789944 15.7954 10.5042 16.8398 10.5142 0 14 14 0 0 0 0 13 15 0 0 0 -0 TG(15:0_18:3_18:3)+H TG(51:6)+H TG (15:0_18:3_18:3) (15:0) (18:3) (18:3) 837.69666647 C54 H93 O6 6.8122194115E7 1.6360031136E7 9.795 1.009961965308931 4.162769127660493 0.98 389.8340073598279 0.0 0.0 6.7156102866E7 0.0 0.0 0.0 0.0 0.0 6.8122194115E7 0.0 0.0 0.0 0.0 0.0 1.5424447914E7 0.0 0.0 0.0 0.0 0.0 1.6360031136E7 0.0 0.0 0.0 9.78 9.795 0.0 0.0 0.04 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 1.0 -7692 -7691 -7690 -7689 -7688 -7687 -7686 -7685 3080 -7684 -7683 -7682 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 837.69667 837.693523 9.795 9.795 9.78 9.795 9.795 9.795 9.795 9.795 9.795 9.795 9.795 9.795 6821832.0 1 1 1 1 1 1 1 1 1 1 1 1 837.69666647 837.69666647 3.5300000718052615E-6 837.69666647 837.69666647 837.69666647 837.69666647 837.69666647 0.003143469999940862 837.69666647 837.69666647 837.69666647 1000000.0 1000000.0 0.004213935918690539 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.752515827939537 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.208034730282344 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 57.577396642887315 0.0 0.0 0.0 0.97 0.98 207.98428987267476 389.8340073598279 13.1412 13.137 0 0 14 0 0 0 0 0 13 0 0 0 -0 TG(51:7)+NH4 TG(51:7)+NH4 TG (51:7) (51:7) 852.7075654699998 C54 H94 O6 N1 3.47893821583E8 9.4278467592E7 9.290028198901027 31.058865085162925 29.05841111307856 0.9 511.3236200914932 0.0 1.94730838932E8 3.33182701145E8 0.0 0.0 0.0 0.0 1.98243027107E8 3.47893821583E8 0.0 0.0 0.0 0.0 5.4632357034E7 9.4278467592E7 0.0 0.0 0.0 0.0 5.6181373101E7 9.0803842976E7 0.0 0.0 0.0 9.287 9.277 9.292 9.289 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7702 743 -7701 -7700 -7699 -7698 -7697 774 -7696 -7695 -7694 -7693 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 852.708235 852.70757 852.708478 852.70757 9.290028198901027 9.287 9.277 9.290028198901027 9.290028198901027 9.290028198901027 9.290028198901027 9.292 9.289 9.290028198901027 9.290028198901027 9.290028198901027 2.230559E7 2.070676E7 1 1 1 1 1 1 1 1 1 1 1 1 852.7075654699998 6.695300000956195E-4 4.530000182967342E-6 852.7075654699998 852.7075654699998 852.7075654699998 852.7075654699998 9.125300001642245E-4 4.530000182967342E-6 852.7075654699998 852.7075654699998 852.7075654699998 1000000.0 0.785181259329609 0.005312489728492643 1000000.0 1000000.0 1000000.0 1000000.0 1.0701558624746708 0.005312489728492643 1000000.0 1000000.0 1000000.0 0.0 10.634453645649597 0.0 0.0 0.0 0.0 0.0 11.165245283999246 0.0 0.0 0.0 0.0 C C 0.0 52.134180663456966 0.0 0.0 0.0 0.0 0.0 54.480548139975035 0.0 0.0 0.0 0.0 0.89 0.92 0.91 0.9 33674.169217713315 6.305198059914757 83.18164711872885 511.3236200914932 47.5744 59.506 42.9775 47.847 0 13 13 0 0 0 0 13 13 0 0 0 -0 TG(18:0_16:0_18:0)+NH4 TG(52:0)+NH4 TG (18:0_16:0_18:0) (18:0) (16:0) (18:0) 880.83276547 C55 H110 O6 N1 1.0538028808E7 4586459.442 10.485997467987064 4.635214871708135 5.956615647682337 1.0 126.09471818991794 0.0 9869164.306 0.0 0.0 0.0 0.0 0.0 1.0538028808E7 0.0 0.0 0.0 0.0 0.0 4215715.08 0.0 0.0 0.0 0.0 0.0 4586459.442 0.0 0.0 0.0 0.0 10.484 10.487 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.88 1.0 -7712 1110 -7711 -7710 -7709 -7708 -7707 1154 -7706 -7705 -7704 -7703 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 880.83318 880.832924 10.485997467987064 10.484 10.485997467987064 10.485997467987064 10.485997467987064 10.485997467987064 10.485997467987064 10.487 10.485997467987064 10.485997467987064 10.485997467987064 10.485997467987064 788548.0 3584725.5 1 1 1 1 1 1 1 1 1 1 1 1 880.83276547 4.145299999436247E-4 880.83276547 880.83276547 880.83276547 880.83276547 880.83276547 1.585300000215284E-4 880.83276547 880.83276547 880.83276547 880.83276547 1000000.0 0.4706114670046786 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.17997741028280095 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.01664154093161 0.0 0.0 0.0 0.0 0.0 5.973242378968845 0.0 0.0 0.0 0.0 A A 0.0 61.58271789111415 0.0 0.0 0.0 0.0 0.0 61.337658458250964 0.0 0.0 0.0 0.0 0.99 1.0 19.937030380027775 126.09471818991794 19.2613 15.5598 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(18:0_16:0_18:1)+NH4 TG(52:1)+NH4 TG (18:0_16:0_18:1) (18:0) (16:0) (18:1) 878.81711547 C55 H108 O6 N1 3.2319204288E7 1.2613680758E7 10.347 3.488302041973406 0.44932386853905915 1.0 88.18281580049174 0.0 3.0763212125E7 0.0 0.0 0.0 0.0 0.0 3.2319204288E7 0.0 0.0 0.0 0.0 0.0 1.2613680758E7 0.0 0.0 0.0 0.0 0.0 1.253378225E7 0.0 0.0 0.0 0.0 10.343 10.346 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.93 0.94 -7723 -7722 -7721 -7720 -7719 -7718 -7717 1121 -7716 -7715 -7714 -7713 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 878.81712 878.817387 10.347 10.343 10.347 10.347 10.347 10.347 10.347 10.346 10.347 10.347 10.347 10.347 2804712.75 1 1 1 1 1 1 1 1 1 1 1 1 878.81711547 4.530000069280504E-6 878.81711547 878.81711547 878.81711547 878.81711547 878.81711547 2.7153000007729133E-4 878.81711547 878.81711547 878.81711547 878.81711547 1000000.0 0.005154656173096738 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.30897213458578854 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.795440447521689 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 68.22497630618646 0.0 0.0 0.0 0.0 0.99 1.0 73.64267529017528 88.18281580049174 36.3026 40.8608 0 9 0 0 0 0 0 9 0 0 0 0 -0 TG(16:0_18:1_18:1)+NH4 TG(52:2)+NH4 TG (16:0_18:1_18:1) (16:0) (18:1) (18:1) 876.8014654699999 C55 H106 O6 N1 2.52768197585E8 9.5018424728E7 10.195 1.0135351587749937 0.41552638582257223 1.0 390.99231157044665 0.0 2.52768197585E8 0.0 0.0 0.0 0.0 0.0 2.49170912499E8 0.0 0.0 0.0 0.0 0.0 9.4461691361E7 0.0 0.0 0.0 0.0 0.0 9.5018424728E7 0.0 0.0 0.0 0.0 10.196 10.196 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.97 0.95 -7734 -7733 -7732 -7731 -7730 -7729 -7728 1072 -7727 -7726 -7725 -7724 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 876.80147 876.802339 10.195 10.196 10.195 10.195 10.195 10.195 10.195 10.196 10.195 10.195 10.195 10.195 1.0172658E7 1 1 1 1 1 1 1 1 1 1 1 1 876.8014654699999 4.530000069280504E-6 876.8014654699999 876.8014654699999 876.8014654699999 876.8014654699999 876.8014654699999 8.735300000353163E-4 876.8014654699999 876.8014654699999 876.8014654699999 876.8014654699999 1000000.0 0.005166506042336786 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9962688640889419 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 40.98650995714965 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 68.98726950222233 0.0 0.0 0.0 0.0 1.0 1.0 390.99231157044665 377.9158395835311 33.3244 40.3869 0 9 0 0 0 0 0 8 0 0 0 0 -0 TG(18:0_16:0_18:3)+H TG(52:3)+H TG (18:0_16:0_18:3) (18:0) (16:0) (18:3) 857.75926647 C55 H101 O6 3514801.254 1452878.23 10.057902724829246 3.155843591410911 8.585620249010011 0.98 6.498549996007227 0.0 3255632.548 3414415.252 0.0 0.0 0.0 0.0 3514801.254 3378580.973 0.0 0.0 0.0 0.0 1179689.105 1296258.904 0.0 0.0 0.0 0.0 1295778.502 1452878.23 0.0 0.0 0.0 10.06 10.046 10.065 10.055 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7742 1001 3101 -7741 -7740 -7739 -7738 1035 3198 -7737 -7736 -7735 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 857.762402 857.759517 857.759358 857.758909 10.057902724829246 10.06 10.046 10.057902724829246 10.057902724829246 10.057902724829246 10.057902724829246 10.065 10.055 10.057902724829246 10.057902724829246 10.057902724829246 1075644.5 622478.1875 1018106.3125 1160295.0 1 1 1 1 1 1 1 1 1 1 1 1 857.75926647 0.0031355300000086572 2.505300000166244E-4 857.75926647 857.75926647 857.75926647 857.75926647 9.15300000770003E-5 3.5746999992625206E-4 857.75926647 857.75926647 857.75926647 1000000.0 3.6554895092098922 0.29207495600443817 1000000.0 1000000.0 1000000.0 1000000.0 0.10670826146091136 0.4167486308802874 1000000.0 1000000.0 1000000.0 0.0 37.411331066908154 30.0135812248306 0.0 0.0 0.0 0.0 27.396109468029927 49.53894627435076 0.0 0.0 0.0 A A A A 0.0 53.7562936951071 50.50220693021765 0.0 0.0 0.0 0.0 54.93617623892886 62.261783104957644 0.0 0.0 0.0 0.99 1.0 0.98 0.99 8.632260781525831 39.06752396756622 6.498549996007227 20.961117155649124 7.9582 9.2136 9.8852 9.7128 0 10 12 0 0 0 0 13 10 0 0 0 -0 TG(16:0_18:2_18:2)+NH4 TG(52:4)+NH4 TG (16:0_18:2_18:2) (16:0) (18:2) (18:2) 872.77016547 C55 H102 O6 N1 5.78104991751E8 1.93204519803E8 9.893 0.12030488279436431 0.5023959298530866 1.0 2673.4159974306253 0.0 5.78104991751E8 0.0 0.0 0.0 0.0 0.0 5.77122258431E8 0.0 0.0 0.0 0.0 0.0 1.93204519803E8 0.0 0.0 0.0 0.0 0.0 1.91836670336E8 0.0 0.0 0.0 0.0 9.896 9.894 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.93 0.94 -7753 -7752 -7751 -7750 -7749 -7748 -7747 963 -7746 -7745 -7744 -7743 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 872.77017 872.769156 9.893 9.896 9.893 9.893 9.893 9.893 9.893 9.894 9.893 9.893 9.893 9.893 5772445.0 1 1 1 1 1 1 1 1 1 1 1 1 872.77016547 4.5299999555936665E-6 872.77016547 872.77016547 872.77016547 872.77016547 872.77016547 0.0010094700000990997 872.77016547 872.77016547 872.77016547 872.77016547 1000000.0 0.005190369853160817 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.1566275292596473 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 26.15333072777756 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 52.368845509069075 0.0 0.0 0.0 0.0 1.0 0.98 2673.4159974306253 223.61542056050067 56.6641 35.7928 0 11 0 0 0 0 0 11 0 0 0 0 -0 TG(16:1_18:2_18:2)+NH4 TG(52:5)+NH4 TG (16:1_18:2_18:2) (16:1) (18:2) (18:2) 870.75451547 C55 H100 O6 N1 9.0770168506E8 3.0920099501E8 9.732475380661434 0.026311598701699117 4.119266855414218 0.99 1680.887137436948 0.0 9.0770168506E8 0.0 0.0 0.0 0.0 0.0 9.07363990097E8 0.0 0.0 0.0 0.0 0.0 2.91698233467E8 0.0 0.0 0.0 0.0 0.0 3.0920099501E8 0.0 0.0 0.0 0.0 9.735 9.733 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.91 0.92 -7764 935 -7763 -7762 -7761 -7760 -7759 -7758 -7757 -7756 -7755 -7754 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 870.754105 870.75452 9.732475380661434 9.735 9.732475380661434 9.732475380661434 9.732475380661434 9.732475380661434 9.732475380661434 9.733 9.732475380661434 9.732475380661434 9.732475380661434 9.732475380661434 994460.6875 1 1 1 1 1 1 1 1 1 1 1 1 870.75451547 4.104700000198136E-4 870.75451547 870.75451547 870.75451547 870.75451547 870.75451547 4.5299999555936665E-6 870.75451547 870.75451547 870.75451547 870.75451547 1000000.0 0.4713957754192725 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005202384684905763 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.190082070005901 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 52.77982698516651 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.98 1680.887137436948 666.2406880974116 55.3633 23.0297 0 11 0 0 0 0 0 11 0 0 0 0 -0 TG(16:0_18:3_18:3)+H TG(52:6)+H TG (16:0_18:3_18:3) (16:0) (18:3) (18:3) 851.71231647 C55 H95 O6 4.4613761273E7 1.7945587744E7 9.572868137096595 30.504545386021597 36.01238612741446 0.97 235.97915194742174 0.0 2.4447899004E7 4.4613761273E7 0.0 0.0 0.0 0.0 2.7351885555E7 4.4059511236E7 0.0 0.0 0.0 0.0 8232278.5 1.7945587744E7 0.0 0.0 0.0 0.0 9863211.567 1.5949387397E7 0.0 0.0 0.0 9.577 9.559 9.573 9.563 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -7773 822 2907 -7772 -7771 -7770 -7769 849 -7768 -7767 -7766 -7765 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 851.713217 851.711884 851.713174 851.71232 9.572868137096595 9.577 9.559 9.572868137096595 9.572868137096595 9.572868137096595 9.572868137096595 9.573 9.563 9.572868137096595 9.572868137096595 9.572868137096595 4572092.0 2173278.5 3980324.0 1 1 1 1 1 1 1 1 1 1 1 1 851.71231647 9.005299999671479E-4 4.3246999996426894E-4 851.71231647 851.71231647 851.71231647 851.71231647 8.575299999620256E-4 3.529999958118424E-6 851.71231647 851.71231647 851.71231647 1000000.0 1.0573171040891802 0.5077653470560113 1000000.0 1000000.0 1000000.0 1000000.0 1.0068305733984657 0.0041445918884311 1000000.0 1000000.0 1000000.0 0.0 38.45643765928019 22.907959840248036 0.0 0.0 0.0 0.0 47.22500390845715 0.0 0.0 0.0 0.0 A B A 0.0 47.774149739240016 56.96527138724419 0.0 0.0 0.0 0.0 47.007596568663175 0.0 0.0 0.0 0.0 0.98 0.97 0.98 0.97 -0.23184263823787424 235.97915194742174 0.6753945840059103 1.3098268077735171 11.0698 9.9107 10.311 8.3312 0 10 11 0 0 0 0 12 11 0 0 0 -0 TG(16:0_18:3_18:3)+NH4 TG(52:6)+NH4 TG (16:0_18:3_18:3) (16:0) (18:3) (18:3) 868.73886547 C55 H98 O6 N1 2.147244160003E9 7.65503321302E8 9.572868137096595 0.8966503942210914 7.114560447042245 0.97 608.6726013374779 0.0 2.147244160003E9 0.0 0.0 0.0 0.0 0.0 2.120187466783E9 0.0 0.0 0.0 0.0 0.0 6.92171297999E8 0.0 0.0 0.0 0.0 0.0 7.65503321302E8 0.0 0.0 0.0 0.0 9.567 9.569 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.93 0.89 -7783 809 -7782 -7781 -7780 -7779 -7778 892 -7777 -7776 -7775 -7774 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 868.739418 868.738616 9.572868137096595 9.567 9.572868137096595 9.572868137096595 9.572868137096595 9.572868137096595 9.572868137096595 9.569 9.572868137096595 9.572868137096595 9.572868137096595 9.572868137096595 1.2915093E7 8215434.5 1 1 1 1 1 1 1 1 1 1 1 1 868.73886547 5.525300000499556E-4 868.73886547 868.73886547 868.73886547 868.73886547 868.73886547 2.4946999997155217E-4 868.73886547 868.73886547 868.73886547 868.73886547 1000000.0 0.6360139070686437 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.287163392691756 1000000.0 1000000.0 1000000.0 1000000.0 0.0 19.87287526924335 0.0 0.0 0.0 0.0 0.0 19.80640000555112 0.0 0.0 0.0 0.0 B B 0.0 49.776888214885886 0.0 0.0 0.0 0.0 0.0 49.73079683330686 0.0 0.0 0.0 0.0 0.97 0.97 608.6726013374779 466.9053620502334 54.0258 55.95 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(16:1_16:1_20:4)+H TG(52:6)+H TG (16:1_16:1_20:4) (16:1) (16:1) (20:4) 851.71231647 C55 H95 O6 1.89739765653E8 5.8105487088E7 9.885 30.10190903912859 29.0799765515189 0.98 6.6242684E7 0.0 1.00753268805E8 1.71011039756E8 0.0 0.0 0.0 0.0 1.13558226302E8 1.89739765653E8 0.0 0.0 0.0 0.0 3.3738590156E7 5.8105487088E7 0.0 0.0 0.0 0.0 3.5004413334E7 5.6823130073E7 0.0 0.0 0.0 9.886 9.873 9.885 9.88 0.0 0.021 0.023 0.0 0.0 0.0 0.0 0.023 0.023 0.0 0.0 0.0 0.0 0.025 0.023 0.0 0.0 0.0 0.0 0.028 0.029 0.0 0.0 0.0 0.89 0.87 0.93 0.92 -7794 -7793 -7792 -7791 -7790 -7789 -7788 961 -7787 -7786 -7785 -7784 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 851.71232 851.71232 851.7099 851.71232 9.885 9.886 9.873 9.885 9.885 9.885 9.885 9.885 9.88 9.885 9.885 9.885 1604567.5 1 1 1 1 1 1 1 1 1 1 1 1 851.71231647 3.529999958118424E-6 3.529999958118424E-6 851.71231647 851.71231647 851.71231647 851.71231647 0.002416470000071058 3.529999958118424E-6 851.71231647 851.71231647 851.71231647 1000000.0 0.0041445918884311 0.0041445918884311 1000000.0 1000000.0 1000000.0 1000000.0 2.837190390866179 0.0041445918884311 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.362984634447155 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 63.71311584783922 0.0 0.0 0.0 0.0 0.98 0.98 0.97 0.98 3.7007268E7 6.5296168E7 3.8357316E7 6.6242684E7 26.4713 28.5624 29.9493 32.4306 0 12 12 0 0 0 0 12 12 0 0 0 -0 TG(16:1_18:3_18:3)+NH4 TG(52:7)+NH4 TG (16:1_18:3_18:3) (16:1) (18:3) (18:3) 866.7232154699999 C55 H96 O6 N1 1.450071529744E9 3.88201598934E8 9.390475736012448 1.4726070554510746 4.523709924767356 1.0 1453.2269552822904 0.0 1.450071529744E9 0.0 0.0 0.0 0.0 0.0 1.420183835171E9 0.0 0.0 0.0 0.0 0.0 3.64136223213E8 0.0 0.0 0.0 0.0 0.0 3.88201598934E8 0.0 0.0 0.0 0.0 9.387 9.389 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.92 0.96 -7804 793 -7803 -7802 -7801 -7800 -7799 830 -7798 -7797 -7796 -7795 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 866.723263 866.723383 9.390475736012448 9.387 9.390475736012448 9.390475736012448 9.390475736012448 9.390475736012448 9.390475736012448 9.389 9.390475736012448 9.390475736012448 9.390475736012448 9.390475736012448 1.0107174E7 3748472.25 1 1 1 1 1 1 1 1 1 1 1 1 866.7232154699999 4.753000007440278E-5 866.7232154699999 866.7232154699999 866.7232154699999 866.7232154699999 866.7232154699999 1.6753000011249242E-4 866.7232154699999 866.7232154699999 866.7232154699999 866.7232154699999 1000000.0 0.05483872962676854 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.1932912342974978 1000000.0 1000000.0 1000000.0 1000000.0 0.0 26.228410083315726 0.0 0.0 0.0 0.0 0.0 5.222000380353589 0.0 0.0 0.0 0.0 A A 0.0 52.93109789295946 0.0 0.0 0.0 0.0 0.0 52.595427848259504 0.0 0.0 0.0 0.0 1.0 1.0 1453.2269552822904 95.53500672205648 61.1951 50.7195 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(52:9)+NH4 TG(52:9)+NH4 TG (52:9) (52:9) 862.69191547 C55 H92 O6 N1 2.599041991782E9 1.163292380878E9 9.086 1.5681192998409372 0.11218082186105598 0.99 1643.6395391449628 0.0 2.542036287088E9 0.0 0.0 0.0 0.0 0.0 2.599041991782E9 0.0 0.0 0.0 0.0 0.0 1.163292380878E9 0.0 0.0 0.0 0.0 0.0 1.161448307762E9 0.0 0.0 0.0 0.0 9.004 9.008 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7815 678 -7814 -7813 -7812 -7811 -7810 -7809 -7808 -7807 -7806 -7805 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 862.692668 862.69192 9.086 9.004 9.086 9.086 9.086 9.086 9.086 9.008 9.086 9.086 9.086 9.086 2693759.0 1 1 1 1 1 1 1 1 1 1 1 1 862.69191547 7.525299999997515E-4 862.69191547 862.69191547 862.69191547 862.69191547 862.69191547 4.5299999555936665E-6 862.69191547 862.69191547 862.69191547 862.69191547 1000000.0 0.8723044536586023 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005251005456711268 1000000.0 1000000.0 1000000.0 1000000.0 0.0 10.404420196283272 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 51.24706479633001 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 1364.3447002729922 1643.6395391449628 141.1034 166.209 0 7 0 0 0 0 0 7 0 0 0 0 -0 TG(17:0_18:1_18:1)+NH4 TG(53:2)+NH4 TG (17:0_18:1_18:1) (17:0) (18:1) (18:1) 890.81711547 C56 H108 O6 N1 6464359.073 2114545.103 10.273 7.466037637160749 7.280345977664917 0.99 2098105.25 0.0 5816041.618 0.0 0.0 0.0 0.0 0.0 6464359.073 0.0 0.0 0.0 0.0 0.0 1907491.388 0.0 0.0 0.0 0.0 0.0 2114545.103 0.0 0.0 0.0 0.0 10.272 10.274 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.87 1.0 -7826 1073 -7825 -7824 -7823 -7822 -7821 -7820 -7819 -7818 -7817 -7816 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 890.817271 890.81712 10.273 10.272 10.273 10.273 10.273 10.273 10.273 10.274 10.273 10.273 10.273 10.273 1989777.625 1 1 1 1 1 1 1 1 1 1 1 1 890.81711547 1.5553000002910267E-4 890.81711547 890.81711547 890.81711547 890.81711547 890.81711547 4.530000069280504E-6 890.81711547 890.81711547 890.81711547 890.81711547 1000000.0 0.1745925143647966 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0050852189418143946 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.815107421253243 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 68.6410311269246 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 2039331.0 2098105.25 3.8651 4.3179 0 12 0 0 0 0 0 12 0 0 0 0 -0 TG(16:0_18:3_19:0)+NH4 TG(53:3)+NH4 TG (16:0_18:3_19:0) (16:0) (18:3) (19:0) 888.8014654699999 C56 H106 O6 N1 1.7189654215E7 4805082.315 10.03 0.5321563252955588 2.6597206207088484 0.89 1.7340231527191106 0.0 1.7060772822E7 0.0 0.0 0.0 0.0 0.0 1.7189654215E7 0.0 0.0 0.0 0.0 0.0 4805082.315 0.0 0.0 0.0 0.0 0.0 4627679.747 0.0 0.0 0.0 0.0 10.028 10.029 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7836 1020 -7835 -7834 -7833 -7832 -7831 1026 -7830 -7829 -7828 -7827 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 888.800947 888.798991 10.03 10.028 10.03 10.03 10.03 10.03 10.03 10.029 10.03 10.03 10.03 10.03 5131938.5 4325605.5 1 1 1 1 1 1 1 1 1 1 1 1 888.8014654699999 5.184699999745135E-4 888.8014654699999 888.8014654699999 888.8014654699999 888.8014654699999 888.8014654699999 0.0024744699999246222 888.8014654699999 888.8014654699999 888.8014654699999 888.8014654699999 1000000.0 0.5833361218642293 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.7840525652330217 1000000.0 1000000.0 1000000.0 1000000.0 0.0 11.33830919782285 0.0 0.0 0.0 0.0 0.0 21.257189101605032 0.0 0.0 0.0 0.0 C A 0.0 55.58475120903351 0.0 0.0 0.0 0.0 0.0 53.588610077841906 0.0 0.0 0.0 0.0 0.91 0.89 112.11131860031475 1.7340231527191106 5.4377 12.4041 0 16 0 0 0 0 0 12 0 0 0 0 -0 TG(18:0_17:1_18:3)+NH4 TG(53:4)+NH4 TG (18:0_17:1_18:3) (18:0) (17:1) (18:3) 886.7858154699999 C56 H104 O6 N1 4.2460064108E7 1.0797642601E7 9.979 3.8310923303739135 2.675013253953993 0.96 81.86516884934309 0.0 4.2460064108E7 0.0 0.0 0.0 0.0 0.0 4.0220261233E7 0.0 0.0 0.0 0.0 0.0 1.0797642601E7 0.0 0.0 0.0 0.0 0.0 1.039674649E7 0.0 0.0 0.0 0.0 9.974 9.981 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.031 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 1.0 0.89 -7847 -7846 -7845 -7844 -7843 -7842 -7841 1027 -7840 -7839 -7838 -7837 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 886.78582 886.785108 9.979 9.974 9.979 9.979 9.979 9.979 9.979 9.981 9.979 9.979 9.979 9.979 3034058.5 1 1 1 1 1 1 1 1 1 1 1 1 886.7858154699999 4.530000069280504E-6 886.7858154699999 886.7858154699999 886.7858154699999 886.7858154699999 886.7858154699999 7.074699998383949E-4 886.7858154699999 886.7858154699999 886.7858154699999 886.7858154699999 1000000.0 0.005108336184741055 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7977912901814211 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.536437645755612 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 56.675652736382176 0.0 0.0 0.0 0.0 0.96 0.98 81.86516884934309 781.7380054855981 5.0057 9.0816 0 14 0 0 0 0 0 15 0 0 0 0 -0 TG(18:1_17:1_18:3)+NH4 TG(53:5)+NH4 TG (18:1_17:1_18:3) (18:1) (17:1) (18:3) 884.77016547 C56 H102 O6 N1 7.3657326126E7 1.9000975706E7 9.821 0.5468037878134019 1.7760378627117606 1.0 19.538284392940124 0.0 7.3089929818E7 0.0 0.0 0.0 0.0 0.0 7.3657326126E7 0.0 0.0 0.0 0.0 0.0 1.9000975706E7 0.0 0.0 0.0 0.0 0.0 1.8529647963E7 0.0 0.0 0.0 0.0 9.82 9.822 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7868 913 -7867 -7866 -7865 -7864 -7863 -7862 -7861 -7860 -7859 -7858 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 884.769971 884.77017 9.821 9.82 9.821 9.821 9.821 9.821 9.821 9.822 9.821 9.821 9.821 9.821 1.0922878E7 1 1 1 1 1 1 1 1 1 1 1 1 884.77016547 1.9446999999672698E-4 884.77016547 884.77016547 884.77016547 884.77016547 884.77016547 4.5299999555936665E-6 884.77016547 884.77016547 884.77016547 884.77016547 1000000.0 0.21979719432947006 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005119973674956906 1000000.0 1000000.0 1000000.0 1000000.0 0.0 23.157409110321165 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 58.23729986261057 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 171.02327137461947 19.538284392940124 8.587 8.7235 0 13 0 0 0 0 0 14 0 0 0 0 -0 TG(17:0_18:3_18:3)+NH4 TG(53:6)+NH4 TG (17:0_18:3_18:3) (17:0) (18:3) (18:3) 882.75451547 C56 H100 O6 N1 1.13748639738E8 2.8520049213E7 9.657 1.5188207756854721 1.5107231684269857 1.0 30.797641211646337 0.0 1.11331351599E8 0.0 0.0 0.0 0.0 0.0 1.13748639738E8 0.0 0.0 0.0 0.0 0.0 2.8520049213E7 0.0 0.0 0.0 0.0 0.0 2.7917162873E7 0.0 0.0 0.0 0.0 9.655 9.652 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7879 853 -7878 -7877 -7876 -7875 -7874 -7873 -7872 -7871 -7870 -7869 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 882.754209 882.75452 9.657 9.655 9.657 9.657 9.657 9.657 9.657 9.652 9.657 9.657 9.657 9.657 1.3737609E7 1 1 1 1 1 1 1 1 1 1 1 1 882.75451547 3.064700000550147E-4 882.75451547 882.75451547 882.75451547 882.75451547 882.75451547 4.5299999555936665E-6 882.75451547 882.75451547 882.75451547 882.75451547 1000000.0 0.34717466145369147 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005131664439214773 1000000.0 1000000.0 1000000.0 1000000.0 0.0 27.098095174728165 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 54.472576293130594 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 25.731982283406893 30.797641211646337 15.3642 14.8634 0 13 0 0 0 0 0 13 0 0 0 0 -0 TG(18:0_18:0_18:0)+NH4 TG(54:0)+NH4 TG (18:0_18:0_18:0) (18:0) (18:0) (18:0) 908.8640654699999 C57 H114 O6 N1 3878843.261 1548369.086 10.622 2.2127992010762916 2.951680729696007 0.97 76.08414195362397 0.0 3878843.261 0.0 0.0 0.0 0.0 0.0 3759329.887 0.0 0.0 0.0 0.0 0.0 1548369.086 0.0 0.0 0.0 0.0 0.0 1485056.832 0.0 0.0 0.0 0.0 10.624 10.626 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7890 1130 -7889 -7888 -7887 -7886 -7885 -7884 -7883 -7882 -7881 -7880 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 908.863921 908.86407 10.622 10.624 10.622 10.622 10.622 10.622 10.622 10.626 10.622 10.622 10.622 10.622 748065.625 1 1 1 1 1 1 1 1 1 1 1 1 908.8640654699999 1.4446999989559117E-4 908.8640654699999 908.8640654699999 908.8640654699999 908.8640654699999 908.8640654699999 4.530000069280504E-6 908.8640654699999 908.8640654699999 908.8640654699999 908.8640654699999 1000000.0 0.15895666402090786 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004984243784506883 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.140487510197901 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 52.958821551720234 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 76.08414195362397 68.69752829895086 20.7722 16.4631 0 15 0 0 0 0 0 15 0 0 0 0 -0 TG(18:0_18:0_18:1)+NH4 TG(54:1)+NH4 TG (18:0_18:0_18:1) (18:0) (18:0) (18:1) 906.8484154699998 C57 H112 O6 N1 8576044.254 3705748.8 10.492493452548937 1.608614202709154 0.09762311355315074 1.0 66.2036003024298 0.0 8576044.254 0.0 0.0 0.0 0.0 0.0 8383139.976 0.0 0.0 0.0 0.0 0.0 3700636.175 0.0 0.0 0.0 0.0 0.0 3705748.8 0.0 0.0 0.0 0.0 10.492 10.493 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.91 0.92 -7900 1113 -7899 -7898 -7897 -7896 -7895 1157 -7894 -7893 -7892 -7891 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 906.849647 906.849254 10.492493452548937 10.492 10.492493452548937 10.492493452548937 10.492493452548937 10.492493452548937 10.492493452548937 10.493 10.492493452548937 10.492493452548937 10.492493452548937 10.492493452548937 4132249.5 3654901.75 1 1 1 1 1 1 1 1 1 1 1 1 906.8484154699998 0.0012315300001546348 906.8484154699998 906.8484154699998 906.8484154699998 906.8484154699998 906.8484154699998 8.385300001236828E-4 906.8484154699998 906.8484154699998 906.8484154699998 906.8484154699998 1000000.0 1.3580329183421018 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.9246639083435911 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.904329677574433 0.0 0.0 0.0 0.0 0.0 6.025440234980362 0.0 0.0 0.0 0.0 A A 0.0 60.04326996035502 0.0 0.0 0.0 0.0 0.0 61.274887144773594 0.0 0.0 0.0 0.0 1.0 1.0 66.2036003024298 60.13231426811651 28.5321 29.617 0 11 0 0 0 0 0 10 0 0 0 0 -0 TG(18:0_18:1_18:1)+NH4 TG(54:2)+NH4 TG (18:0_18:1_18:1) (18:0) (18:1) (18:1) 904.83276547 C57 H110 O6 N1 2.0649261646E8 8.3387979718E7 10.350001058246493 3.3692117075170476 1.2962257329942775 0.99 890.539042798504 0.0 1.96882634943E8 0.0 0.0 0.0 0.0 0.0 2.0649261646E8 0.0 0.0 0.0 0.0 0.0 8.1873244902E7 0.0 0.0 0.0 0.0 0.0 8.3387979718E7 0.0 0.0 0.0 0.0 10.35 10.351 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.97 0.96 -7910 1089 -7909 -7908 -7907 -7906 -7905 1124 -7904 -7903 -7902 -7901 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 904.833239 904.832915 10.350001058246493 10.35 10.350001058246493 10.350001058246493 10.350001058246493 10.350001058246493 10.350001058246493 10.351 10.350001058246493 10.350001058246493 10.350001058246493 10.350001058246493 6.5223192E7 2.6584148E7 1 1 1 1 1 1 1 1 1 1 1 1 904.83276547 4.735300000220377E-4 904.83276547 904.83276547 904.83276547 904.83276547 904.83276547 1.4952999993056437E-4 904.83276547 904.83276547 904.83276547 904.83276547 1000000.0 0.5233342757830731 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.16525705703516774 1000000.0 1000000.0 1000000.0 1000000.0 0.0 52.12977463329776 0.0 0.0 0.0 0.0 0.0 34.61553817407751 0.0 0.0 0.0 0.0 A A 0.0 74.47354604030461 0.0 0.0 0.0 0.0 0.0 69.44849456168926 0.0 0.0 0.0 0.0 0.99 0.99 729.9820383545762 890.539042798504 55.4936 78.1888 0 9 0 0 0 0 0 8 0 0 0 0 -0 TG(18:1_18:1_18:1)+H TG(54:3)+H TG (18:1_18:1_18:1) (18:1) (18:1) (18:1) 885.79056647 C57 H105 O6 6715294.766 3119765.642 10.205491291158635 3.1218489926622297 7.013835279844861 0.98 43.25129473729435 0.0 6715294.766 0.0 0.0 0.0 0.0 0.0 6425220.443 0.0 0.0 0.0 0.0 0.0 3119765.642 0.0 0.0 0.0 0.0 0.0 2824936.335 0.0 0.0 0.0 0.0 10.203 10.211 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -7920 1044 -7919 -7918 -7917 -7916 -7915 1084 -7914 -7913 -7912 -7911 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 885.793056 885.791919 10.205491291158635 10.203 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 10.211 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 1561808.25 1982097.75 1 1 1 1 1 1 1 1 1 1 1 1 885.79056647 0.002489529999934348 885.79056647 885.79056647 885.79056647 885.79056647 885.79056647 0.001352529999962826 885.79056647 885.79056647 885.79056647 885.79056647 1000000.0 2.8105176259163325 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.52691849649387 1000000.0 1000000.0 1000000.0 1000000.0 0.0 72.85957354622572 0.0 0.0 0.0 0.0 0.0 68.02402407721458 0.0 0.0 0.0 0.0 A A 0.0 60.3373920512947 0.0 0.0 0.0 0.0 0.0 56.24018655401146 0.0 0.0 0.0 0.0 0.98 0.99 43.25129473729435 30.87458438727947 10.8349 16.1296 0 8 0 0 0 0 0 8 0 0 0 0 -0 TG(18:1_18:1_18:1)+NH4 TG(54:3)+NH4 TG (18:1_18:1_18:1) (18:1) (18:1) (18:1) 902.81711547 C57 H108 O6 N1 1.299726673203E9 5.10488409576E8 10.205491291158635 2.2655310318614346 3.10124306359005 1.0 181.75816843835486 0.0 1.299726673203E9 0.0 0.0 0.0 0.0 0.0 1.258740732634E9 0.0 0.0 0.0 0.0 0.0 5.10488409576E8 0.0 0.0 0.0 0.0 0.0 4.88579744123E8 0.0 0.0 0.0 0.0 10.205 10.204 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.92 0.94 -7930 1040 -7929 -7928 -7927 -7926 -7925 1075 -7924 -7923 -7922 -7921 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 902.817039 902.816962 10.205491291158635 10.205 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 10.204 10.205491291158635 10.205491291158635 10.205491291158635 10.205491291158635 1.78127376E8 6.2935412E7 1 1 1 1 1 1 1 1 1 1 1 1 902.81711547 7.646999995358783E-5 902.81711547 902.81711547 902.81711547 902.81711547 902.81711547 1.534699999865552E-4 902.81711547 902.81711547 902.81711547 902.81711547 1000000.0 0.08470153992791564 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.16999013128662258 1000000.0 1000000.0 1000000.0 1000000.0 0.0 42.76411012545772 0.0 0.0 0.0 0.0 0.0 63.34634977249114 0.0 0.0 0.0 0.0 A A 0.0 71.86223354936179 0.0 0.0 0.0 0.0 0.0 70.44298001679358 0.0 0.0 0.0 0.0 1.0 1.0 181.75816843835486 49.76040784413738 53.4722 55.7453 0 8 0 0 0 0 0 8 0 0 0 0 -0 TG(18:1_18:1_18:2)+NH4 TG(54:4)+NH4 TG (18:1_18:1_18:2) (18:1) (18:1) (18:2) 900.8014654699999 C57 H106 O6 N1 2.13435276559E8 6.5567015988E7 10.065028348382159 4.205403589957544 4.3355894182701125 0.98 372.2196379569797 0.0 2.01108126256E8 0.0 0.0 0.0 0.0 0.0 2.13435276559E8 0.0 0.0 0.0 0.0 0.0 6.166639006E7 0.0 0.0 0.0 0.0 0.0 6.5567015988E7 0.0 0.0 0.0 0.0 10.063 10.065 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.91 0.88 -7950 1041 -7949 -7948 -7947 -7946 -7945 1021 -7944 -7943 -7942 -7941 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 900.801025 900.79937 10.065028348382159 10.063 10.065028348382159 10.065028348382159 10.065028348382159 10.065028348382159 10.065028348382159 10.065 10.065028348382159 10.065028348382159 10.065028348382159 10.065028348382159 739977.3125 1719674.75 1 1 1 1 1 1 1 1 1 1 1 1 900.8014654699999 4.404699999440709E-4 900.8014654699999 900.8014654699999 900.8014654699999 900.8014654699999 900.8014654699999 0.0020954699999720106 900.8014654699999 900.8014654699999 900.8014654699999 900.8014654699999 1000000.0 0.4889756698100533 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.3262284535457356 1000000.0 1000000.0 1000000.0 1000000.0 0.0 30.724636477843024 0.0 0.0 0.0 0.0 0.0 8.666021930005346 0.0 0.0 0.0 0.0 A A 0.0 61.76264766310449 0.0 0.0 0.0 0.0 0.0 53.07418186467153 0.0 0.0 0.0 0.0 0.97 0.98 175.56642171620962 372.2196379569797 17.4119 24.0767 0 14 0 0 0 0 0 14 0 0 0 0 -0 TG(18:1_18:1_18:3)+NH4 TG(54:5)+NH4 TG (18:1_18:1_18:3) (18:1) (18:1) (18:3) 898.7858154699999 C57 H104 O6 N1 2.10143106667E8 6.8584105046E7 9.911 0.98624253452188 5.096484827854136 0.98 161.78540005298373 0.0 2.10143106667E8 0.0 0.0 0.0 0.0 0.0 2.07232418306E8 0.0 0.0 0.0 0.0 0.0 6.8584105046E7 0.0 0.0 0.0 0.0 0.0 6.3812838308E7 0.0 0.0 0.0 0.0 9.912 9.91 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.027 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 1.0 0.89 -7961 944 -7960 -7959 -7958 -7957 -7956 -7955 -7954 -7953 -7952 -7951 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 898.784407 898.78582 9.911 9.912 9.911 9.911 9.911 9.911 9.911 9.91 9.911 9.911 9.911 9.911 3.670022E7 1 1 1 1 1 1 1 1 1 1 1 1 898.7858154699999 0.0014084699998875294 898.7858154699999 898.7858154699999 898.7858154699999 898.7858154699999 898.7858154699999 4.530000069280504E-6 898.7858154699999 898.7858154699999 898.7858154699999 898.7858154699999 1000000.0 1.5670808057323442 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0050401330231403816 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.616535998196133 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 56.38899175983861 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.98 0.99 161.78540005298373 134.41039024942327 28.5397 23.2071 0 10 0 0 0 0 0 11 0 0 0 0 -0 TG(18:1_18:3_18:3)+H TG(54:7)+H TG (18:1_18:3_18:3) (18:1) (18:3) (18:3) 877.7279664700001 C57 H97 O6 1.011125709E7 3784018.68 9.575964921441187 0.22899784329388148 10.30313953652913 0.99 -0.4275478270981943 0.0 1.0078564534E7 0.0 0.0 0.0 0.0 0.0 1.011125709E7 0.0 0.0 0.0 0.0 0.0 3270096.755 0.0 0.0 0.0 0.0 0.0 3784018.68 0.0 0.0 0.0 0.0 9.575 9.572 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.95 0.96 -7972 -7971 -7970 -7969 -7968 -7967 -7966 863 -7965 -7964 -7963 -7962 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 877.72797 877.728267 9.575964921441187 9.575 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 9.572 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 4437393.0 1 1 1 1 1 1 1 1 1 1 1 1 877.7279664700001 3.529999958118424E-6 877.7279664700001 877.7279664700001 877.7279664700001 877.7279664700001 877.7279664700001 3.0052999989038653E-4 877.7279664700001 877.7279664700001 877.7279664700001 877.7279664700001 1000000.0 0.004021747161954052 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.34239537917316476 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 33.20738961401048 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 41.66073590810951 0.0 0.0 0.0 0.0 0.99 0.99 -0.44423058219382167 -0.4275478270981943 24.9146 12.4115 0 8 0 0 0 0 0 9 0 0 0 0 -0 TG(18:1_18:3_18:3)+NH4 TG(54:7)+NH4 TG (18:1_18:3_18:3) (18:1) (18:3) (18:3) 894.75451547 C57 H100 O6 N1 6.45580650767E8 2.42557498023E8 9.575964921441187 0.37975992981423895 6.344184553047557 1.0 3700.4514698357925 0.0 6.45580650767E8 0.0 0.0 0.0 0.0 0.0 6.42122770191E8 0.0 0.0 0.0 0.0 0.0 2.21729508981E8 0.0 0.0 0.0 0.0 0.0 2.42557498023E8 0.0 0.0 0.0 0.0 9.574 9.574 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.97 0.96 -7983 818 -7982 -7981 -7980 -7979 -7978 -7977 -7976 -7975 -7974 -7973 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 894.753507 894.75452 9.575964921441187 9.574 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 9.574 9.575964921441187 9.575964921441187 9.575964921441187 9.575964921441187 3.7629684E7 1 1 1 1 1 1 1 1 1 1 1 1 894.75451547 0.0010084699999879376 894.75451547 894.75451547 894.75451547 894.75451547 894.75451547 4.5299999555936665E-6 894.75451547 894.75451547 894.75451547 894.75451547 1000000.0 1.1270912664332347 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005062841122644831 1000000.0 1000000.0 1000000.0 1000000.0 0.0 22.333437208492672 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 55.80489754038865 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 3700.4514698357925 497.25390042435214 80.5535 80.0123 0 9 0 0 0 0 0 9 0 0 0 0 -0 TG(18:3_18:2_18:3)+NH4 TG(54:8)+NH4 TG (18:3_18:2_18:3) (18:3) (18:2) (18:3) 892.73886547 C57 H98 O6 N1 7.90825150081E8 2.99355646764E8 9.392475936082864 1.2705562994321387 4.006697777430778 1.0 1970.5208833226063 0.0 7.76741830875E8 0.0 0.0 0.0 0.0 0.0 7.90825150081E8 0.0 0.0 0.0 0.0 0.0 2.82860512965E8 0.0 0.0 0.0 0.0 0.0 2.99355646764E8 0.0 0.0 0.0 0.0 9.392 9.396 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.98 0.95 -7994 753 -7993 -7992 -7991 -7990 -7989 -7988 -7987 -7986 -7985 -7984 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 892.737445 892.73887 9.392475936082864 9.392 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 9.396 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 7626368.5 1 1 1 1 1 1 1 1 1 1 1 1 892.73886547 0.0014204699999709192 892.73886547 892.73886547 892.73886547 892.73886547 892.73886547 4.530000069280504E-6 892.73886547 892.73886547 892.73886547 892.73886547 1000000.0 1.5911371789813193 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.005074272269859783 1000000.0 1000000.0 1000000.0 1000000.0 0.0 28.366264758036067 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 56.68968398784271 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 3.33474784E8 1970.5208833226063 90.3032 65.5485 0 8 0 0 0 0 0 9 0 0 0 0 -0 TG(18:3_18:2_18:3)+H TG(54:8)+H TG (18:3_18:2_18:3) (18:3) (18:2) (18:3) 875.71231647 C57 H95 O6 1.316017729E7 4562651.519 9.392475936082864 12.1930761296415 5.263894691443373 0.96 5754530.5 0.0 1.1071011043E7 0.0 0.0 0.0 0.0 0.0 1.316017729E7 0.0 0.0 0.0 0.0 0.0 4235184.143 0.0 0.0 0.0 0.0 0.0 4562651.519 0.0 0.0 0.0 0.0 9.391 9.393 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.94 0.96 -8005 763 -8004 -8003 -8002 -8001 -8000 -7999 -7998 -7997 -7996 -7995 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 875.712534 875.71232 9.392475936082864 9.391 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 9.393 9.392475936082864 9.392475936082864 9.392475936082864 9.392475936082864 4390728.0 1 1 1 1 1 1 1 1 1 1 1 1 875.71231647 2.1752999998625455E-4 875.71231647 875.71231647 875.71231647 875.71231647 875.71231647 3.529999958118424E-6 875.71231647 875.71231647 875.71231647 875.71231647 1000000.0 0.24840349495496294 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004031004122846951 1000000.0 1000000.0 1000000.0 1000000.0 0.0 18.792094743083627 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 46.842944319955976 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.96 29.979447074133017 5754530.5 19.6614 35.7534 0 8 0 0 0 0 0 8 0 0 0 0 -0 TG(18:3_18:3_18:3)+H TG(54:9)+H TG (18:3_18:3_18:3) (18:3) (18:3) (18:3) 873.69666647 C57 H93 O6 2.494373621E7 9502845.904 9.211 2.8091222211075557 8.64767844644201 1.0 1.1102555E7 0.0 2.494373621E7 0.0 0.0 0.0 0.0 0.0 2.3972096867E7 0.0 0.0 0.0 0.0 0.0 9502845.904 0.0 0.0 0.0 0.0 0.0 8407649.205 0.0 0.0 0.0 0.0 9.21 9.214 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.92 0.89 -8016 -8015 -8014 -8013 -8012 -8011 -8010 723 -8009 -8008 -8007 -8006 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 873.69667 873.695598 9.211 9.21 9.211 9.211 9.211 9.211 9.211 9.214 9.211 9.211 9.211 9.211 5445476.5 1 1 1 1 1 1 1 1 1 1 1 1 873.69666647 3.5300000718052615E-6 873.69666647 873.69666647 873.69666647 873.69666647 873.69666647 0.001068469999950139 873.69666647 873.69666647 873.69666647 873.69666647 1000000.0 0.004040303926152694 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.2229301552300553 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 55.28932940566754 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 45.74918339742587 0.0 0.0 0.0 0.0 1.0 0.99 1.1102555E7 3.207196736804893 17.9703 41.6147 0 8 0 0 0 0 0 8 0 0 0 0 -0 TG(18:3_18:3_18:3)+NH4 TG(54:9)+NH4 TG (18:3_18:3_18:3) (18:3) (18:3) (18:3) 890.7232154699999 C57 H96 O6 N1 1.603464261812E9 6.12444842587E8 9.211 2.090043235470222 0.1156903639509393 1.0 638.086350168391 0.0 1.556759823753E9 0.0 0.0 0.0 0.0 0.0 1.603464261812E9 0.0 0.0 0.0 0.0 0.0 6.12444842587E8 0.0 0.0 0.0 0.0 0.0 6.11443635222E8 0.0 0.0 0.0 0.0 9.21 9.213 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.98 0.97 -8026 698 -8025 -8024 -8023 -8022 -8021 717 -8020 -8019 -8018 -8017 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 890.722255 890.721707 9.211 9.21 9.211 9.211 9.211 9.211 9.211 9.213 9.211 9.211 9.211 9.211 3.50473056E8 1.2104072E8 1 1 1 1 1 1 1 1 1 1 1 1 890.7232154699999 9.604699998817523E-4 890.7232154699999 890.7232154699999 890.7232154699999 890.7232154699999 890.7232154699999 0.0015084699998624274 890.7232154699999 890.7232154699999 890.7232154699999 890.7232154699999 1000000.0 1.0783035439072393 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.6935339437251185 1000000.0 1000000.0 1000000.0 1000000.0 0.0 34.39915669244485 0.0 0.0 0.0 0.0 0.0 46.95173609329426 0.0 0.0 0.0 0.0 A A 0.0 57.805487472589014 0.0 0.0 0.0 0.0 0.0 52.268880596553004 0.0 0.0 0.0 0.0 1.0 1.0 722.8964623836744 638.086350168391 147.2518 151.6303 0 8 0 0 0 0 0 7 0 0 0 0 -0 TG(18:3_18:3_18:3)+H TG(54:9)+H TG (18:3_18:3_18:3) (18:3) (18:3) (18:3) 873.69666647 C57 H93 O6 6.04549900691E8 1.39781666059E8 9.574 1.9909774262760371 5.703944767041662 0.94 1.37181824E8 0.0 6.04549900691E8 0.0 0.0 0.0 0.0 0.0 5.8776410306E8 0.0 0.0 0.0 0.0 0.0 1.28943191681E8 0.0 0.0 0.0 0.0 0.0 1.39781666059E8 0.0 0.0 0.0 0.0 9.569 9.571 0.0 0.032 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.042 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.89 0.91 -8037 -8036 -8035 -8034 -8033 -8032 -8031 854 -8030 -8029 -8028 -8027 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 873.69667 873.693447 9.574 9.569 9.574 9.574 9.574 9.574 9.574 9.571 9.574 9.574 9.574 9.574 1.26114392E8 1 1 1 1 1 1 1 1 1 1 1 1 873.69666647 3.5300000718052615E-6 873.69666647 873.69666647 873.69666647 873.69666647 873.69666647 0.0032194699999763543 873.69666647 873.69666647 873.69666647 873.69666647 1000000.0 0.004040303926152694 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.68488300749045 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.013134430241376 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 25.96572738356982 0.0 0.0 0.0 0.0 0.94 0.92 1.37181824E8 1.59508592E8 32.7702 43.2418 0 13 0 0 0 0 0 14 0 0 0 0 -0 TG(19:1_18:1_18:1)+NH4 TG(55:3)+NH4 TG (19:1_18:1_18:1) (19:1) (18:1) (18:1) 916.83276547 C58 H110 O6 N1 3602083.592 1145228.963 10.283 4.1595006408814115 9.292539399143095 0.99 1076416.13 0.0 3602083.592 0.0 0.0 0.0 0.0 0.0 3396247.889 0.0 0.0 0.0 0.0 0.0 1004006.613 0.0 0.0 0.0 0.0 0.0 1145228.963 0.0 0.0 0.0 0.0 10.28 10.28 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.89 1.0 -8048 -8047 -8046 -8045 -8044 -8043 -8042 1112 -8041 -8040 -8039 -8038 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 916.83277 916.832341 10.283 10.28 10.283 10.283 10.283 10.283 10.283 10.28 10.283 10.283 10.283 10.283 1052833.125 1 1 1 1 1 1 1 1 1 1 1 1 916.83276547 4.5299999555936665E-6 916.83276547 916.83276547 916.83276547 916.83276547 916.83276547 4.24469999984467E-4 916.83276547 916.83276547 916.83276547 916.83276547 1000000.0 0.004940922844605617 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4629742914640153 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.369161858785659 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 64.1495152428474 0.0 0.0 0.0 0.0 0.99 0.98 1076416.13 83.7819861189416 5.0691 4.6551 0 11 0 0 0 0 0 12 0 0 0 0 -0 TG(16:0_18:1_22:0)+NH4 TG(56:1)+NH4 TG (16:0_18:1_22:0) (16:0) (18:1) (22:0) 934.87971547 C59 H116 O6 N1 3973449.189 1672070.41 10.638501301041671 1.9747462965086 0.5078680980316206 0.99 426.98502592584 0.0 3864010.314 0.0 0.0 0.0 0.0 0.0 3973449.189 0.0 0.0 0.0 0.0 0.0 1672070.41 0.0 0.0 0.0 0.0 0.0 1660104.006 0.0 0.0 0.0 0.0 10.639 10.638 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8058 1125 -8057 -8056 -8055 -8054 -8053 1173 -8052 -8051 -8050 -8049 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 934.880291 934.879967 10.638501301041671 10.639 10.638501301041671 10.638501301041671 10.638501301041671 10.638501301041671 10.638501301041671 10.638 10.638501301041671 10.638501301041671 10.638501301041671 10.638501301041671 1072243.25 1312943.125 1 1 1 1 1 1 1 1 1 1 1 1 934.87971547 5.75530000105573E-4 934.87971547 934.87971547 934.87971547 934.87971547 934.87971547 2.5153000001409964E-4 934.87971547 934.87971547 934.87971547 934.87971547 1000000.0 0.6156193043681902 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.2690506552360545 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.405368269352863 0.0 0.0 0.0 0.0 0.0 6.38652311597954 0.0 0.0 0.0 0.0 A A 0.0 64.51418232747578 0.0 0.0 0.0 0.0 0.0 64.53054383524301 0.0 0.0 0.0 0.0 0.99 0.99 331.61639602241945 426.98502592584 29.0279 30.5429 0 13 0 0 0 0 0 13 0 0 0 0 -0 TG(18:3_18:3_20:5)+NH4 TG(56:11)+NH4 TG (18:3_18:3_20:5) (18:3) (18:3) (20:5) 914.7232154699999 C59 H96 O6 N1 4915124.653 1979505.896 9.144 4.590353613919166 4.517236372434286 0.99 38.250176274556 0.0 4915124.653 0.0 0.0 0.0 0.0 0.0 4606078.752 0.0 0.0 0.0 0.0 0.0 1979505.896 0.0 0.0 0.0 0.0 0.0 1856962.628 0.0 0.0 0.0 0.0 9.145 9.146 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.94 0.97 -8069 680 -8068 -8067 -8066 -8065 -8064 -8063 -8062 -8061 -8060 -8059 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 914.722459 914.72322 9.144 9.145 9.144 9.144 9.144 9.144 9.144 9.146 9.144 9.144 9.144 9.144 1104889.875 1 1 1 1 1 1 1 1 1 1 1 1 914.7232154699999 7.564699999420554E-4 914.7232154699999 914.7232154699999 914.7232154699999 914.7232154699999 914.7232154699999 4.530000069280504E-6 914.7232154699999 914.7232154699999 914.7232154699999 914.7232154699999 1000000.0 0.8269933321342113 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004952317807909703 1000000.0 1000000.0 1000000.0 1000000.0 0.0 22.07401838664155 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 44.20052155829617 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.99 0.99 38.250176274556 567.7237029571311 25.3387 34.5598 0 7 0 0 0 0 0 7 0 0 0 0 -0 TG(18:3_18:3_20:5)+H TG(56:11)+H TG (18:3_18:3_20:5) (18:3) (18:3) (20:5) 897.69666647 C59 H93 O6 1.42632269921E8 4.0997747241E7 9.395 5.473150833005676 1.4224780835059108 0.99 392.34764200978816 0.0 1.3200358213E8 0.0 0.0 0.0 0.0 0.0 1.42632269921E8 0.0 0.0 0.0 0.0 0.0 4.0181213616E7 0.0 0.0 0.0 0.0 0.0 4.0997747241E7 0.0 0.0 0.0 0.0 9.395 9.397 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.028 0.0 0.0 0.0 0.0 0.96 0.92 -8080 770 -8079 -8078 -8077 -8076 -8075 -8074 -8073 -8072 -8071 -8070 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 897.693449 897.69667 9.395 9.395 9.395 9.395 9.395 9.395 9.395 9.397 9.395 9.395 9.395 9.395 4.9376808E7 1 1 1 1 1 1 1 1 1 1 1 1 897.69666647 0.003217469999981404 897.69666647 897.69666647 897.69666647 897.69666647 897.69666647 3.5300000718052615E-6 897.69666647 897.69666647 897.69666647 897.69666647 1000000.0 3.584139409399186 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00393228604232901 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.204409535198813 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 40.23413343993333 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 0.99 41.066639556787756 392.34764200978816 35.4509 39.5461 0 10 0 0 0 0 0 9 0 0 0 0 -0 TG(20:0_18:1_18:1)+NH4 TG(56:2)+NH4 TG (20:0_18:1_18:1) (20:0) (18:1) (18:1) 932.8640654699999 C59 H114 O6 N1 1.6252584424E7 6969273.216 10.498085740185404 0.17071704404432156 3.9705392068330227 1.0 372.2468015559149 0.0 1.6213393061E7 0.0 0.0 0.0 0.0 0.0 1.6252584424E7 0.0 0.0 0.0 0.0 0.0 6588622.39 0.0 0.0 0.0 0.0 0.0 6969273.216 0.0 0.0 0.0 0.0 10.499 10.5 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.91 0.92 -8090 1111 -8089 -8088 -8087 -8086 -8085 1153 -8084 -8083 -8082 -8081 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 932.863987 932.863494 10.498085740185404 10.499 10.498085740185404 10.498085740185404 10.498085740185404 10.498085740185404 10.498085740185404 10.5 10.498085740185404 10.498085740185404 10.498085740185404 10.498085740185404 559059.6875 748686.5625 1 1 1 1 1 1 1 1 1 1 1 1 932.8640654699999 7.846999994853832E-5 932.8640654699999 932.8640654699999 932.8640654699999 932.8640654699999 932.8640654699999 5.714699999543882E-4 932.8640654699999 932.8640654699999 932.8640654699999 932.8640654699999 1000000.0 0.08411729302597072 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.6125972916176887 1000000.0 1000000.0 1000000.0 1000000.0 0.0 33.221128075435 0.0 0.0 0.0 0.0 0.0 44.182173942267994 0.0 0.0 0.0 0.0 A A 0.0 66.39207764506703 0.0 0.0 0.0 0.0 0.0 73.47393883127472 0.0 0.0 0.0 0.0 1.0 1.0 366.2670033476745 372.2468015559149 28.8296 33.7832 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(20:0_18:3_18:3)+NH4 TG(56:6)+NH4 TG (20:0_18:3_18:3) (20:0) (18:3) (18:3) 924.8014654699999 C59 H106 O6 N1 9823135.429 2887513.391 9.819 7.783485372451576 2.7017404281833923 0.99 126.30411287675852 0.0 8798259.425 0.0 0.0 0.0 0.0 0.0 9823135.429 0.0 0.0 0.0 0.0 0.0 2779254.384 0.0 0.0 0.0 0.0 0.0 2887513.391 0.0 0.0 0.0 0.0 9.819 9.816 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 0.9 0.91 -8112 919 -8111 -8110 -8109 -8108 -8107 -8106 -8105 -8104 -8103 -8102 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 924.800179 924.80147 9.819 9.819 9.819 9.819 9.819 9.819 9.819 9.816 9.819 9.819 9.819 9.819 2709217.25 1 1 1 1 1 1 1 1 1 1 1 1 924.8014654699999 0.0012864699999681761 924.8014654699999 924.8014654699999 924.8014654699999 924.8014654699999 924.8014654699999 4.530000069280504E-6 924.8014654699999 924.8014654699999 924.8014654699999 924.8014654699999 1000000.0 1.391076947866178 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.004898348714205682 1000000.0 1000000.0 1000000.0 1000000.0 0.0 28.913308333260133 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 A 0.0 57.89536304270367 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.94 0.99 3461904.75 126.30411287675852 6.277 4.572 0 8 0 0 0 0 0 7 0 0 0 0 -0 TG(18:1_18:1_20:4)+H TG(56:6)+H TG (18:1_18:1_20:4) (18:1) (18:1) (20:4) 907.77491647 C59 H103 O6 3.43102466001E8 1.12302399195E8 10.205941749658654 6.576077137926129 3.7396276871023066 1.0 65.88313826205817 0.0 3.43102466001E8 0.0 0.0 0.0 0.0 0.0 3.12611825303E8 0.0 0.0 0.0 0.0 0.0 1.12302399195E8 0.0 0.0 0.0 0.0 0.0 1.06516145203E8 0.0 0.0 0.0 0.0 10.204 10.206 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.025 0.0 0.0 0.0 0.0 0.0 0.024 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.95 0.92 -8122 1043 -8121 -8120 -8119 -8118 -8117 1086 -8116 -8115 -8114 -8113 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 907.771738 907.771937 10.205941749658654 10.204 10.205941749658654 10.205941749658654 10.205941749658654 10.205941749658654 10.205941749658654 10.206 10.205941749658654 10.205941749658654 10.205941749658654 10.205941749658654 1.03266704E8 1.19771152E8 1 1 1 1 1 1 1 1 1 1 1 1 907.77491647 0.0031784699999661825 907.77491647 907.77491647 907.77491647 907.77491647 907.77491647 0.002979470000013862 907.77491647 907.77491647 907.77491647 907.77491647 1000000.0 3.501385577303759 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.2821682401182835 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.298061428853308 0.0 0.0 0.0 0.0 0.0 5.944804735977089 0.0 0.0 0.0 0.0 A A 0.0 48.68891316634274 0.0 0.0 0.0 0.0 0.0 45.95796418479062 0.0 0.0 0.0 0.0 1.0 0.99 65.88313826205817 75.5484303392861 77.9886 56.6427 0 9 0 0 0 0 0 8 0 0 0 0 -0 TG(16:1_18:1_22:5)+H TG(56:7)+H TG (16:1_18:1_22:5) (16:1) (18:1) (22:5) 905.75926647 C59 H101 O6 6.9325329987E7 1.8950743042E7 10.063989417484057 8.561721290289563 6.103255934399139 0.96 123.32057359590254 0.0 6.9325329987E7 0.0 0.0 0.0 0.0 0.0 6.1410515016E7 0.0 0.0 0.0 0.0 0.0 1.8950743042E7 0.0 0.0 0.0 0.0 0.0 1.7382716755E7 0.0 0.0 0.0 0.0 10.062 10.064 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.026 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.03 0.0 0.0 0.0 0.0 1.0 0.87 -8133 -8132 -8131 -8130 -8129 -8128 -8127 1031 -8126 -8125 -8124 -8123 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 905.75927 905.755431 10.063989417484057 10.062 10.063989417484057 10.063989417484057 10.063989417484057 10.063989417484057 10.063989417484057 10.064 10.063989417484057 10.063989417484057 10.063989417484057 10.063989417484057 1.0288616E7 1 1 1 1 1 1 1 1 1 1 1 1 905.75926647 3.5300000718052615E-6 905.75926647 905.75926647 905.75926647 905.75926647 905.75926647 0.0038354699998990327 905.75926647 905.75926647 905.75926647 905.75926647 1000000.0 0.0038972828680656725 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 4.234535755672635 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.660114966023194 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 51.36167283967335 0.0 0.0 0.0 0.0 0.96 0.97 123.32057359590254 435.0284979479893 10.0936 35.8823 0 16 0 0 0 0 0 16 0 0 0 0 -0 TG(16:0_18:1_24:0)+NH4 TG(58:1)+NH4 TG (16:0_18:1_24:0) (16:0) (18:1) (24:0) 962.91101547 C61 H120 O6 N1 1751874.989 675419.432 10.778 5.767154614427168 1.8558508038111685 0.99 90.69579617397181 0.0 1751874.989 0.0 0.0 0.0 0.0 0.0 1614590.715 0.0 0.0 0.0 0.0 0.0 657922.194 0.0 0.0 0.0 0.0 0.0 675419.432 0.0 0.0 0.0 0.0 10.774 10.777 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.95 0.94 -8144 -8143 -8142 -8141 -8140 -8139 -8138 1186 -8137 -8136 -8135 -8134 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 962.91102 962.911118 10.778 10.774 10.778 10.778 10.778 10.778 10.778 10.777 10.778 10.778 10.778 10.778 283557.3125 1 1 1 1 1 1 1 1 1 1 1 1 962.91101547 4.5299999555936665E-6 962.91101547 962.91101547 962.91101547 962.91101547 962.91101547 1.0252999993554113E-4 962.91101547 962.91101547 962.91101547 962.91101547 1000000.0 0.004704484508760717 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.10647920554268028 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.433562570336078 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 65.00583868914332 0.0 0.0 0.0 0.0 0.99 1.0 90.69579617397181 46.20634549773689 23.7026 24.8847 0 17 0 0 0 0 0 16 0 0 0 0 -0 TG(18:1_18:1_22:0)+NH4 TG(58:2)+NH4 TG (18:1_18:1_22:0) (18:1) (18:1) (22:0) 960.89536547 C61 H118 O6 N1 3.4351001761E7 1.4213411545E7 10.64349916644223 2.6551214601427318 1.1985943287190022 1.0 540.3913043321987 0.0 3.3084923031E7 0.0 0.0 0.0 0.0 0.0 3.4351001761E7 0.0 0.0 0.0 0.0 0.0 1.3974509282E7 0.0 0.0 0.0 0.0 0.0 1.4213411545E7 0.0 0.0 0.0 0.0 10.642 10.645 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.97 0.93 -8154 1131 -8153 -8152 -8151 -8150 -8149 1177 -8148 -8147 -8146 -8145 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 960.895402 960.895042 10.64349916644223 10.642 10.64349916644223 10.64349916644223 10.64349916644223 10.64349916644223 10.64349916644223 10.645 10.64349916644223 10.64349916644223 10.64349916644223 10.64349916644223 1.2911297E7 1.4015401E7 1 1 1 1 1 1 1 1 1 1 1 1 960.89536547 3.652999998848827E-5 960.89536547 960.89536547 960.89536547 960.89536547 960.89536547 3.234700000120938E-4 960.89536547 960.89536547 960.89536547 960.89536547 1000000.0 0.03801662626463023 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3366339474994511 1000000.0 1000000.0 1000000.0 1000000.0 0.0 6.762515339393331 0.0 0.0 0.0 0.0 0.0 34.720758282421386 0.0 0.0 0.0 0.0 A A 0.0 68.11132931815807 0.0 0.0 0.0 0.0 0.0 69.52407115467885 0.0 0.0 0.0 0.0 1.0 1.0 64.67193751607564 540.3913043321987 82.5729 58.5891 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(16:0_18:3_24:1)+NH4 TG(58:4)+NH4 TG (16:0_18:3_24:1) (16:0) (18:3) (24:1) 956.8640654699999 C61 H114 O6 N1 5201367.04 1440081.806 10.38949813187498 1.0126088357968839 0.5402767115080781 0.97 81.07057025493994 0.0 5127410.66 0.0 0.0 0.0 0.0 0.0 5201367.04 0.0 0.0 0.0 0.0 0.0 1440081.806 0.0 0.0 0.0 0.0 0.0 1429120.497 0.0 0.0 0.0 0.0 10.389 10.389 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8164 1104 -8163 -8162 -8161 -8160 -8159 1146 -8158 -8157 -8156 -8155 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 956.864153 956.863955 10.38949813187498 10.389 10.38949813187498 10.38949813187498 10.38949813187498 10.38949813187498 10.38949813187498 10.389 10.38949813187498 10.38949813187498 10.38949813187498 10.38949813187498 1006138.0625 1330728.375 1 1 1 1 1 1 1 1 1 1 1 1 956.8640654699999 8.753000008709932E-5 956.8640654699999 956.8640654699999 956.8640654699999 956.8640654699999 956.8640654699999 1.1046999986774608E-4 956.8640654699999 956.8640654699999 956.8640654699999 956.8640654699999 1000000.0 0.09147589845387877 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.11545004547065374 1000000.0 1000000.0 1000000.0 1000000.0 0.0 25.003111129656478 0.0 0.0 0.0 0.0 0.0 22.88906553055301 0.0 0.0 0.0 0.0 A A 0.0 62.57519171713156 0.0 0.0 0.0 0.0 0.0 57.4230808808654 0.0 0.0 0.0 0.0 0.95 0.97 9.912316938991259 81.07057025493994 8.7359 12.9843 0 19 0 0 0 0 0 17 0 0 0 0 -0 TG(18:3_18:3_22:1)+NH4 TG(58:7)+NH4 TG (18:3_18:3_22:1) (18:3) (18:3) (22:1) 950.81711547 C61 H108 O6 N1 7383579.001 1909539.607 9.957459116163347 5.726929580197117 3.895546258196854 0.95 9.735924232060482 0.0 6808849.411 0.0 0.0 0.0 0.0 0.0 7383579.001 0.0 0.0 0.0 0.0 0.0 1807160.603 0.0 0.0 0.0 0.0 0.0 1909539.607 0.0 0.0 0.0 0.0 9.96 9.955 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8174 965 -8173 -8172 -8171 -8170 -8169 996 -8168 -8167 -8166 -8165 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 950.816474 950.815869 9.957459116163347 9.96 9.957459116163347 9.957459116163347 9.957459116163347 9.957459116163347 9.957459116163347 9.955 9.957459116163347 9.957459116163347 9.957459116163347 9.957459116163347 1630355.375 1432367.625 1 1 1 1 1 1 1 1 1 1 1 1 950.81711547 6.414700000050289E-4 950.81711547 950.81711547 950.81711547 950.81711547 950.81711547 0.0012464699999554796 950.81711547 950.81711547 950.81711547 950.81711547 1000000.0 0.6746512968352939 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 1.3109461111660101 1000000.0 1000000.0 1000000.0 1000000.0 0.0 26.979667353578357 0.0 0.0 0.0 0.0 0.0 28.29838938466906 0.0 0.0 0.0 0.0 A A 0.0 54.234512750980656 0.0 0.0 0.0 0.0 0.0 56.664063069688666 0.0 0.0 0.0 0.0 0.95 0.95 10.109529834882192 9.735924232060482 8.1433 11.7077 0 16 0 0 0 0 0 16 0 0 0 0 -0 TG(18:1_18:1_23:0)+NH4 TG(59:2)+NH4 TG (18:1_18:1_23:0) (18:1) (18:1) (23:0) 974.91101547 C62 H120 O6 N1 1226781.471 519322.019 10.716434380700324 0.7283178913647331 0.03406062791519161 0.98 12.588017978630381 0.0 1226781.471 0.0 0.0 0.0 0.0 0.0 1214210.399 0.0 0.0 0.0 0.0 0.0 519071.927 0.0 0.0 0.0 0.0 0.0 519322.019 0.0 0.0 0.0 0.0 10.71 10.719 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8184 1135 -8183 -8182 -8181 -8180 -8179 1182 -8178 -8177 -8176 -8175 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 974.910989 974.910231 10.716434380700324 10.71 10.716434380700324 10.716434380700324 10.716434380700324 10.716434380700324 10.716434380700324 10.719 10.716434380700324 10.716434380700324 10.716434380700324 10.716434380700324 380869.4375 320460.40625 1 1 1 1 1 1 1 1 1 1 1 1 974.91101547 2.6470000079825695E-5 974.91101547 974.91101547 974.91101547 974.91101547 974.91101547 7.844700000987359E-4 974.91101547 974.91101547 974.91101547 974.91101547 1000000.0 0.02715119601665864 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.804658053556351 1000000.0 1000000.0 1000000.0 1000000.0 0.0 21.859105210046877 0.0 0.0 0.0 0.0 0.0 27.613508633710104 0.0 0.0 0.0 0.0 A A 0.0 44.46220293469016 0.0 0.0 0.0 0.0 0.0 55.29267314568901 0.0 0.0 0.0 0.0 0.98 0.99 12.588017978630381 36259.343750003536 11.9327 7.9235 0 17 0 0 0 0 0 17 0 0 0 0 -0 TG(18:1_18:2_23:1)+NH4 TG(59:4)+NH4 TG (18:1_18:2_23:1) (18:1) (18:2) (23:1) 970.87971547 C62 H116 O6 N1 1.6288980871E7 2877797.19 10.388 0.4014310113004924 2.026430739497153 0.9 157.3477296187358 0.0 1.619676858E7 0.0 0.0 0.0 0.0 0.0 1.6288980871E7 0.0 0.0 0.0 0.0 0.0 2796490.161 0.0 0.0 0.0 0.0 0.0 2877797.19 0.0 0.0 0.0 0.0 10.374 10.386 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8195 -8194 -8193 -8192 -8191 -8190 -8189 1141 -8188 -8187 -8186 -8185 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 970.87972 970.878977 10.388 10.374 10.388 10.388 10.388 10.388 10.388 10.386 10.388 10.388 10.388 10.388 2687903.5 1 1 1 1 1 1 1 1 1 1 1 1 970.87971547 4.530000069280504E-6 970.87971547 970.87971547 970.87971547 970.87971547 970.87971547 7.384699999875011E-4 970.87971547 970.87971547 970.87971547 970.87971547 1000000.0 0.004665871577188679 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.7606194549342397 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.18472214673078 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 71.90429861885562 0.0 0.0 0.0 0.0 0.97 0.9 155.5973919243618 157.3477296187358 11.4107 9.0229 0 23 0 0 0 0 0 22 0 0 0 0 -0 TG(18:1_20:4_22:6)+NH4 TG(60:11)+NH4 TG (18:1_20:4_22:6) (18:1) (20:4) (22:6) 970.7858154699999 C63 H104 O6 N1 6044254.921 865568.928 9.266 0.6202275811320938 2.581287731567328 0.47 19.26868549948585 0.0 6044254.921 0.0 0.0 0.0 0.0 0.0 5991470.187 0.0 0.0 0.0 0.0 0.0 865568.928 0.0 0.0 0.0 0.0 0.0 834537.797 0.0 0.0 0.0 0.0 9.307 9.265 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8206 -8205 -8204 -8203 -8202 -8201 -8200 746 -8199 -8198 -8197 -8196 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 970.78582 970.782736 9.266 9.307 9.266 9.266 9.266 9.266 9.266 9.265 9.266 9.266 9.266 9.266 759626.8125 1 1 1 1 1 1 1 1 1 1 1 1 970.7858154699999 4.530000069280504E-6 970.7858154699999 970.7858154699999 970.7858154699999 970.7858154699999 970.7858154699999 0.003079469999875073 970.7858154699999 970.7858154699999 970.7858154699999 970.7858154699999 1000000.0 0.004666322887183238 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.172141527824206 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.92501499184013 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 68.21712919280736 0.0 0.0 0.0 0.0 0.47 0.81 19.26868549948585 20.301017743542022 5.5174 6.5167 0 30 0 0 0 0 0 28 0 0 0 0 -0 TG(18:1_18:1_24:0)+NH4 TG(60:2)+NH4 TG (18:1_18:1_24:0) (18:1) (18:1) (24:0) 988.9266654699999 C63 H122 O6 N1 8226054.058 3608156.197 10.783496702641237 0.7310429144473073 2.205747825233039 1.0 290.28779053753505 0.0 8226054.058 0.0 0.0 0.0 0.0 0.0 8141446.291 0.0 0.0 0.0 0.0 0.0 3608156.197 0.0 0.0 0.0 0.0 0.0 3497331.952 0.0 0.0 0.0 0.0 10.785 10.785 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 1.0 0.95 -8216 1138 -8215 -8214 -8213 -8212 -8211 1185 -8210 -8209 -8208 -8207 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 988.927084 988.927011 10.783496702641237 10.785 10.783496702641237 10.783496702641237 10.783496702641237 10.783496702641237 10.783496702641237 10.785 10.783496702641237 10.783496702641237 10.783496702641237 10.783496702641237 3025600.75 3175675.0 1 1 1 1 1 1 1 1 1 1 1 1 988.9266654699999 4.1853000016089936E-4 988.9266654699999 988.9266654699999 988.9266654699999 988.9266654699999 988.9266654699999 3.4553000011783297E-4 988.9266654699999 988.9266654699999 988.9266654699999 988.9266654699999 1000000.0 0.42321641712632724 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.349399012265096 1000000.0 1000000.0 1000000.0 1000000.0 0.0 41.29034966568902 0.0 0.0 0.0 0.0 0.0 48.70753778554484 0.0 0.0 0.0 0.0 A A 0.0 82.51833275413233 0.0 0.0 0.0 0.0 0.0 81.26335686194423 0.0 0.0 0.0 0.0 1.0 1.0 290.28779053753505 358.3615658401457 65.6105 39.5501 0 14 0 0 0 0 0 14 0 0 0 0 -0 TG(26:1_16:0_18:3)+NH4 TG(60:4)+NH4 TG (26:1_16:0_18:3) (26:1) (16:0) (18:3) 984.89536547 C63 H118 O6 N1 1755740.981 548866.96 10.539488732155114 1.3762622950503696 3.201116418482636 1.0 34.98433913447437 0.0 1721897.838 0.0 0.0 0.0 0.0 0.0 1755740.981 0.0 0.0 0.0 0.0 0.0 524569.394 0.0 0.0 0.0 0.0 0.0 548866.96 0.0 0.0 0.0 0.0 10.54 10.539 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8226 1119 -8225 -8224 -8223 -8222 -8221 1168 -8220 -8219 -8218 -8217 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 984.894992 984.89488 10.539488732155114 10.54 10.539488732155114 10.539488732155114 10.539488732155114 10.539488732155114 10.539488732155114 10.539 10.539488732155114 10.539488732155114 10.539488732155114 10.539488732155114 524618.6875 254030.40625 1 1 1 1 1 1 1 1 1 1 1 1 984.89536547 3.734699999995428E-4 984.89536547 984.89536547 984.89536547 984.89536547 984.89536547 4.854700000578305E-4 984.89536547 984.89536547 984.89536547 984.89536547 1000000.0 0.379197641793471 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4929153056032102 1000000.0 1000000.0 1000000.0 1000000.0 0.0 18.90727030669352 0.0 0.0 0.0 0.0 0.0 17.14158544571416 0.0 0.0 0.0 0.0 B B 0.0 62.82070988330178 0.0 0.0 0.0 0.0 0.0 56.77271764512146 0.0 0.0 0.0 0.0 0.98 1.0 34.91649243730949 34.98433913447437 7.6273 7.8695 0 20 0 0 0 0 0 20 0 0 0 0 -0 TG(18:1_18:3_24:1)+NH4 TG(60:5)+NH4 TG (18:1_18:3_24:1) (18:1) (18:3) (24:1) 982.87971547 C63 H116 O6 N1 1528546.932 416989.407 10.4 3.732813799234992 1.8578972208348286 0.99 60.210138452665205 0.0 1528546.932 0.0 0.0 0.0 0.0 0.0 1449930.092 0.0 0.0 0.0 0.0 0.0 406175.232 0.0 0.0 0.0 0.0 0.0 416989.407 0.0 0.0 0.0 0.0 10.399 10.401 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 -8237 -8236 -8235 -8234 -8233 -8232 -8231 1148 -8230 -8229 -8228 -8227 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 982.87972 982.879296 10.4 10.399 10.4 10.4 10.4 10.4 10.4 10.401 10.4 10.4 10.4 10.4 333922.5625 1 1 1 1 1 1 1 1 1 1 1 1 982.87971547 4.530000069280504E-6 982.87971547 982.87971547 982.87971547 982.87971547 982.87971547 4.194699999970908E-4 982.87971547 982.87971547 982.87971547 982.87971547 1000000.0 0.004608905848783662 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.4267765357193335 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 16.500990238737952 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 0.0 0.0 0.0 0.0 54.6510742927225 0.0 0.0 0.0 0.0 0.99 0.99 60.210138452665205 32.856677588220386 5.1928 4.8999 0 19 0 0 0 0 0 18 0 0 0 0 -0 TG(18:1_20:4_22:0)+H TG(60:5)+H TG (18:1_20:4_22:0) (18:1) (20:4) (22:0) 965.85316647 C63 H113 O6 1.1153530751E7 4643013.708 10.645490461007867 0.006432185541744747 0.2336416558245008 1.0 128.35468496887603 0.0 1.1152516218E7 0.0 0.0 0.0 0.0 0.0 1.1153530751E7 0.0 0.0 0.0 0.0 0.0 4627697.603 0.0 0.0 0.0 0.0 0.0 4643013.708 0.0 0.0 0.0 0.0 10.643 10.645 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.0 0.94 0.97 -8247 1123 -8246 -8245 -8244 -8243 -8242 1170 -8241 -8240 -8239 -8238 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 965.850514 965.849782 10.645490461007867 10.643 10.645490461007867 10.645490461007867 10.645490461007867 10.645490461007867 10.645490461007867 10.645 10.645490461007867 10.645490461007867 10.645490461007867 10.645490461007867 636253.125 890258.75 1 1 1 1 1 1 1 1 1 1 1 1 965.85316647 0.0026524700000436496 965.85316647 965.85316647 965.85316647 965.85316647 965.85316647 0.0033844700000145167 965.85316647 965.85316647 965.85316647 965.85316647 1000000.0 2.7462455910745693 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 3.5041247650345 1000000.0 1000000.0 1000000.0 1000000.0 0.0 5.509333842445895 0.0 0.0 0.0 0.0 0.0 5.782977741888126 0.0 0.0 0.0 0.0 A A 0.0 41.972673715354844 0.0 0.0 0.0 0.0 0.0 44.164356003373626 0.0 0.0 0.0 0.0 1.0 1.0 140.04247100390498 128.35468496887603 106.4176 77.5269 0 12 0 0 0 0 0 11 0 0 0 0 -0 TG(24:1_18:3_18:3)+NH4 TG(60:7)+NH4 TG (24:1_18:3_18:3) (24:1) (18:3) (18:3) 978.8484154699998 C63 H112 O6 N1 4333573.443 938431.175 10.124 4.479581112891194 4.934770881631664 0.99 20.770632601803893 0.0 4067466.945 0.0 0.0 0.0 0.0 0.0 4333573.443 0.0 0.0 0.0 0.0 0.0 938431.175 0.0 0.0 0.0 0.0 0.0 875147.964 0.0 0.0 0.0 0.0 10.125 10.125 0.0 0.039 0.0 0.0 0.0 0.0 0.0 0.041 0.0 0.0 0.0 0.0 0.0 0.029 0.0 0.0 0.0 0.0 0.0 0.036 0.0 0.0 0.0 0.0 0.87 0.89 -8258 1014 -8257 -8256 -8255 -8254 -8253 -8252 -8251 -8250 -8249 -8248 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 978.847447 978.84842 10.124 10.125 10.124 10.124 10.124 10.124 10.124 10.125 10.124 10.124 10.124 10.124 679183.125 1 1 1 1 1 1 1 1 1 1 1 1 978.8484154699998 9.684699998615542E-4 978.8484154699998 978.8484154699998 978.8484154699998 978.8484154699998 978.8484154699998 4.530000182967342E-6 978.8484154699998 978.8484154699998 978.8484154699998 978.8484154699998 1000000.0 0.9893973209289383 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.00462788733308848 1000000.0 1000000.0 1000000.0 1000000.0 0.0 18.521867434963163 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 46.2808704641188 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 13.448388801649873 20.770632601803893 2.4421 10.9178 0 13 0 0 0 0 0 15 0 0 0 0 -0 TG(18:1_20:4_24:0)+H TG(62:5)+H TG (18:1_20:4_24:0) (18:1) (20:4) (24:0) 993.8844664700001 C65 H117 O6 2444856.748 1062665.44 10.783 0.19791969770322745 1.73801260669381 0.99 92.77850555296344 0.0 2438023.14 0.0 0.0 0.0 0.0 0.0 2444856.748 0.0 0.0 0.0 0.0 0.0 1062665.44 0.0 0.0 0.0 0.0 0.0 1036863.064 0.0 0.0 0.0 0.0 10.784 10.784 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.017 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 1.0 0.98 -8269 -8268 -8267 -8266 -8265 -8264 -8263 1184 -8262 -8261 -8260 -8259 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 993.88447 993.881573 10.783 10.784 10.783 10.783 10.783 10.783 10.783 10.784 10.783 10.783 10.783 10.783 650488.1875 1 1 1 1 1 1 1 1 1 1 1 1 993.8844664700001 3.529999844431586E-6 993.8844664700001 993.8844664700001 993.8844664700001 993.8844664700001 993.8844664700001 0.002893470000117304 993.8844664700001 993.8844664700001 993.8844664700001 993.8844664700001 1000000.0 0.0035517205103015232 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 2.911273993841659 1000000.0 1000000.0 1000000.0 1000000.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.512175732706919 0.0 0.0 0.0 0.0 A 0.0 0.0 0.0 0.0 0.0 0.0 0.0 57.37016779712702 0.0 0.0 0.0 0.0 1.0 0.99 85.34387943390942 92.77850555296344 51.7974 54.8302 0 14 0 0 0 0 0 14 0 0 0 0 -0 WE(16:0_14:1)+H WE(30:1)+H WE (16:0_14:1) (16:0) (14:1) 451.45095647000005 H59 C30 O2 2676179.097 812049.908 7.763 25.147997938246746 9.013715882018486 0.97 13.979720608665758 0.0 0.0 1471066.728 2358739.743 0.0 0.0 0.0 0.0 1894377.296 2676179.097 0.0 0.0 0.0 0.0 657743.125 719778.507 0.0 0.0 0.0 0.0 771475.296 812049.908 0.0 0.0 7.758 7.763 7.786 7.765 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 1.0 1.0 1.0 -8280 -8279 -8278 687 -8277 -8276 -8275 -8274 -8273 -8272 -8271 -8270 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 451.45096 451.450984 451.45096 451.45096 7.763 7.763 7.758 7.763 7.763 7.763 7.763 7.763 7.786 7.765 7.763 7.763 171646.15625 1 1 1 1 1 1 1 1 1 1 1 1 451.45095647000005 451.45095647000005 3.529999958118424E-6 2.7529999954367668E-5 451.45095647000005 451.45095647000005 451.45095647000005 451.45095647000005 3.529999958118424E-6 3.529999958118424E-6 451.45095647000005 451.45095647000005 1000000.0 1000000.0 0.007819232427195002 0.060981153234519955 1000000.0 1000000.0 1000000.0 1000000.0 0.007819232427195002 0.007819232427195002 1000000.0 1000000.0 0.0 0.0 0.0 5.307123602126373 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 B 0.0 0.0 0.0 47.38503216184262 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.96 0.85 0.97 6.4003896703057706 10.272372568285375 8.335358701867063 13.979720608665758 6.7386 13.3888 4.8116 13.0263 0 0 7 14 0 0 0 0 7 14 0 0 -0 ZyE(0:0)+H ZyE()+H ZyE (0:0) (0:0) 385.34649147 C27 H45 O1 4628905.257 1054670.012 6.817922937772025 35.1224524571413 13.29095081005693 0.89 86.84867261413955 0.0 0.0 0.0 2787113.058 0.0 0.0 0.0 0.0 0.0 4628905.257 0.0 0.0 0.0 0.0 0.0 1054670.012 0.0 0.0 0.0 0.0 0.0 873461.839 0.0 0.0 6.811 6.818 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.044 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.039 0.0 0.0 0.92 0.84 -8290 -8289 -8288 601 -8287 -8286 -8285 -8284 -8283 651 -8282 -8281 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 385.346404 385.346375 6.817922937772025 6.817922937772025 6.817922937772025 6.811 6.817922937772025 6.817922937772025 6.817922937772025 6.817922937772025 6.817922937772025 6.818 6.817922937772025 6.817922937772025 497794.375 428127.5625 1 1 1 1 1 1 1 1 1 1 1 1 385.34649147 385.34649147 385.34649147 8.746999998265892E-5 385.34649147 385.34649147 385.34649147 385.34649147 385.34649147 1.1646999996628438E-4 385.34649147 385.34649147 1000000.0 1000000.0 1000000.0 0.2269905187120891 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.3022474644104858 1000000.0 1000000.0 0.0 0.0 0.0 9.978444474661469 0.0 0.0 0.0 0.0 0.0 5.616070435973057 0.0 0.0 B B 0.0 0.0 0.0 36.95720175800544 0.0 0.0 0.0 0.0 0.0 31.200391310961432 0.0 0.0 0.97 0.89 172.45029026146275 86.84867261413955 17.4659 17.5344 0 0 0 12 0 0 0 0 0 10 0 0 -0 ZyE()+H-H2O ZyE()+H-H2O ZyE (0:0) (0:0) 367.33592646999995 C27 H43 O0 1.775479981E7 5145644.164 6.817922937772025 18.811697271168413 4.22564717999448 0.93 126.04265719075832 0.0 0.0 0.0 1.3585898178E7 0.0 0.0 0.0 0.0 0.0 1.775479981E7 0.0 0.0 0.0 0.0 0.0 5145644.164 0.0 0.0 0.0 0.0 0.0 4847063.675 0.0 0.0 6.811 6.819 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.038 0.0 0.0 0.0 0.0 0.0 0.018 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.97 0.74 -8300 -8299 -8298 600 -8297 -8296 -8295 -8294 -8293 649 -8292 -8291 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 367.336121 367.335938 6.817922937772025 6.817922937772025 6.817922937772025 6.811 6.817922937772025 6.817922937772025 6.817922937772025 6.817922937772025 6.817922937772025 6.819 6.817922937772025 6.817922937772025 826931.0 498419.625 1 1 1 1 1 1 1 1 1 1 1 1 367.33592646999995 367.33592646999995 367.33592646999995 1.9453000004432397E-4 367.33592646999995 367.33592646999995 367.33592646999995 367.33592646999995 367.33592646999995 1.1530000051607203E-5 367.33592646999995 367.33592646999995 1000000.0 1000000.0 1000000.0 0.5295697644216434 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.03138816331527226 1000000.0 1000000.0 0.0 0.0 0.0 5.418238941765439 0.0 0.0 0.0 0.0 0.0 7.691564092800169 0.0 0.0 C C 0.0 0.0 0.0 31.871993775090807 0.0 0.0 0.0 0.0 0.0 36.626495680000794 0.0 0.0 0.98 0.93 145.8456527205009 126.04265719075832 56.459 63.2932 0 0 0 11 0 0 0 0 0 10 0 0 -0 ZyE(0:0)+H ZyE()+H ZyE (0:0) (0:0) 385.34649147 C27 H45 O1 2.3897013516E7 8922302.705 7.009289500535571 12.568740148480037 3.933027889842818 0.94 209.43889819426002 0.0 0.0 0.0 2.3897013516E7 0.0 0.0 0.0 0.0 0.0 1.9996043775E7 0.0 0.0 0.0 0.0 0.0 8439459.816 0.0 0.0 0.0 0.0 0.0 8922302.705 0.0 0.0 7.013 7.008 0.0 0.0 0.0 0.023 0.0 0.0 0.0 0.0 0.0 0.014 0.0 0.0 0.0 0.0 0.0 0.021 0.0 0.0 0.0 0.0 0.0 0.022 0.0 0.0 0.89 0.83 -8310 -8309 -8308 621 -8307 -8306 -8305 -8304 -8303 672 -8302 -8301 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 385.346617 385.346563 7.009289500535571 7.009289500535571 7.009289500535571 7.013 7.009289500535571 7.009289500535571 7.009289500535571 7.009289500535571 7.009289500535571 7.008 7.009289500535571 7.009289500535571 705381.4375 1308559.25 1 1 1 1 1 1 1 1 1 1 1 1 385.34649147 385.34649147 385.34649147 1.2552999999115855E-4 385.34649147 385.34649147 385.34649147 385.34649147 385.34649147 7.15300000138086E-5 385.34649147 385.34649147 1000000.0 1000000.0 1000000.0 0.3257587723513276 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.18562514930638044 1000000.0 1000000.0 0.0 0.0 0.0 5.098998671985388 0.0 0.0 0.0 0.0 0.0 5.039313354377965 0.0 0.0 B B 0.0 0.0 0.0 21.245827799939114 0.0 0.0 0.0 0.0 0.0 20.997138976574853 0.0 0.0 0.94 0.93 209.43889819426002 260.99524960267246 55.5477 67.2693 0 0 0 12 0 0 0 0 0 10 0 0 -0 phSM(d40:8)+H phSM(d40:8)+H phSM (d40:8) (d40:8) 789.55411747 C45 H78 O7 N2 P1 6497863.675 2934685.812 8.718 0.7217177794459987 1.9772267431530846 0.99 3501796.75 0.0 0.0 6431879.12 0.0 0.0 0.0 0.0 0.0 6497863.675 0.0 0.0 0.0 0.0 0.0 2853756.989 0.0 0.0 0.0 0.0 0.0 2934685.812 0.0 0.0 0.0 8.717 8.724 0.0 0.0 0.015 0.0 0.0 0.0 0.0 0.0 0.016 0.0 0.0 0.0 0.0 0.0 0.02 0.0 0.0 0.0 0.0 0.0 0.019 0.0 0.0 0.0 0.94 0.97 -8321 -8320 2553 -8319 -8318 -8317 -8316 -8315 -8314 -8313 -8312 -8311 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 MS2 789.551759 789.55412 8.718 8.718 8.717 8.718 8.718 8.718 8.718 8.718 8.724 8.718 8.718 8.718 3343293.5 1 1 1 1 1 1 1 1 1 1 1 1 789.55411747 789.55411747 0.0023584700001038073 789.55411747 789.55411747 789.55411747 789.55411747 789.55411747 2.529999960643181E-6 789.55411747 789.55411747 789.55411747 1000000.0 1000000.0 2.9870910022749895 1000000.0 1000000.0 1000000.0 1000000.0 1000000.0 0.0032043401518190564 1000000.0 1000000.0 1000000.0 0.0 0.0 5.159545021600732 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 C 0.0 0.0 17.198483405335775 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.97 0.99 1.5792555449515733 3501796.75 2.7572 5.5382 0 0 6 0 0 0 0 0 6 0 0 0 diff --git a/inst/extdata/daphnia/daphnia_example.xlsx b/inst/extdata/daphnia/daphnia_example.xlsx deleted file mode 100644 index c807958..0000000 Binary files a/inst/extdata/daphnia/daphnia_example.xlsx and /dev/null differ