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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Acylcarnitine C16:0CAR 16:0ME11693011953816C029901.806400.3424
Acylcarnitine C18:0CAR 18:0ME11693152922056-2.607428.3734
Acylcarnitine C18:1CAR 18:1ME1169326441392-1.97426.3576
Acylcarnitine C18:2CAR 18:2ME11693351000598-1.519424.3423
Ceramide (d40:1)Cer 40:1;O2ME1169345283567-7.943644.5949
Ceramide (d42:1)Cer 42:1;O2ME1169355283571-8.572672.6251
Ceramide (d42:2)Cer 42:2;O2ME1169365283568-7.913670.6101
DG (34:1)DG 34:1ME116937--7.166617.5118
DG (34:2)DG 34:2ME116938--6.621615.4962
DG (36:1)DG 36:1ME116939--7.8405640.5874
DG (36:3)DG 36:3ME116940--6.6745641.5117
DG (36:4)DG 36:4ME116941--6.1375634.5403
DG (38:5)DG 38:5ME116942--6.533665.5108
DG (38:6)DG 38:6ME116943--6.26658.54
DG (40:6)DG 40:6ME116944--6.958691.5269
DG (40:7)DG 40:7ME116945--6.3085689.5113
Gal-Gal-Cer(d18:1/16:0) or Lactosylceramide(d18:1/...LacCer 18:1;O2/16:0ME11694644260140-4.953862.6189
LPC (16:0)LPC 16:0ME116947460602C042301.635496.3401
LPC (18:0)LPC 18:0ME116948--2.43524.3714
LPC (18:1)LPC 18:1ME116949--1.79522.3555
LPC (18:2)LPC 18:2ME116950--1.296520.3396
LPC (20:0)LPC 20:0ME116951--3.151552.4028
LPC (20:4)LPC 20:4ME116952--1.256544.3396
LPC (22:6)LPC 22:6ME116953--1.21568.3397
LPC (o-16:0)LPC O-16:0ME116954162126C139031.913482.3613
LPC (p-16:0) or LPC (o-16:1)LPC P-16:0 or LPC O-16:1ME116955--1.837480.3417
PC (30:1)PC 30:1ME116956--4.491704.5237
PC (31:0)PC 31:0ME116957--5.341720.5541
PC (32:0)PC 32:0ME116958--5.682734.5705
PC (32:1)PC 32:1ME116959--5.097732.5541
PC (32:2)PC 32:2ME116960--4.619730.5377
PC (33:1)PC 33:1ME116961--5.428746.5691
PC (33:2)PC 33:2ME116962--4.925744.5534
PC (34:0)PC 34:0ME116963--6.3515762.6012
PC (34:2) APC 34:2ME116964--5.2475758.5697
PC (34:2) BPC 34:2ME116965--5.377780.5592
PC (34:3)PC 34:3ME116966--4.825756.5537
PC (34:4)PC 34:4ME116967--4.528754.5378
PC (35:1)PC 35:1ME116968--6.081774.5998
PC (35:2)PC 35:2ME116969--5.566772.584
PC (35:3)PC 35:3ME116970--5.02770.5681
PC (35:4)PC 35:4ME116971--4.834768.5532
PC (36:1)PC 36:1ME116972--6.4235788.6158
PC (36:2)PC 36:2ME116973--5.901786.6017
PC (36:3) BPC 36:3ME116974--5.321784.5805
PC (36:4) APC 36:4ME116975--5.1425804.5521
PC (36:4) BPC 36:4ME116976--5.7405760.5814
PC (36:5)PC 36:5ME116977--4.7365780.5532
PC (36:6)PC 36:6ME116978--4.364778.5381
PC (37:2)PC 37:2ME116979--6.239800.6128
PC (37:3)PC 37:3ME116980--5.678798.5931
PC (37:4)PC 37:4ME116981--5.478796.5801
PC (37:6)PC 37:6ME116982--4.676792.5543
PC (38:2)PC 38:2ME116983--6.5215814.6322
PC (38:3)PC 38:3ME116984--6.078812.6151
PC (38:4) APC 38:4ME116985--5.448810.5936
PC (38:4) BPC 38:4ME116986--5.806810.5983
PC (38:5)PC 38:5ME116987--5.277808.5825
PC (38:6) APC 38:6ME116988--4.991806.568
PC (38:7)PC 38:7ME116989--4.352804.5556
PC (40:4)PC 40:4ME116990--6.272838.6306
PC (40:5) APC 40:5ME116991--5.784836.6138
PC (40:6)PC 40:6ME116992--5.604834.5981
PC (40:7)PC 40:7ME116993--5.045832.5837
PC (40:8)PC 40:8ME116994--4.579830.5685
PC (42:5)PC 42:5ME116995--6.242842.6689
PC (42:6)PC 42:6ME116996--6.025862.6305
PC (42:7)PC 42:7ME116997--5.659860.6143
PC (o-32:0)PC O-32:0ME116998--6.072742.5695
PC (o-34:0)PC O-34:0ME116999--6.774748.6207
PC (p-34:1) or PC (o-34:2) APC P-34:1 or PC O-34:2ME117000--5.608744.5853
PC (p-36:1) or PC (o-36:2)PC P-36:1 or PC O-36:2ME117001--6.299772.6142
PC (p-38:3) or PC (o-38:4)PC P-38:3 or PC O-38:4ME117002--6.1905818.6025
PC (p-40:3) or PC (o-40:4)PC P-40:3 or PC O-40:4ME117003--6.893824.6535
PC (p-40:5) or PC (o-40:6)PC P-40:5 or PC O-40:6ME117004--6.003820.6187
PC (p-42:3) or PC (o-42:4)PC P-42:3 or PC O-42:4ME117005--7.565852.6852
PC (p-42:4) or PC (o-42:5)PC P-42:4 or PC O-42:5ME117006--6.864850.6672
PC (p-44:4) or PC (o-44:5)PC P-44:4 or PC O-44:5ME117007--7.503878.6985
PE (34:2)PE 34:2ME117008--5.424716.524
PE (36:1)PE 36:1ME117009--6.6145746.57
PE (38:4)PE 38:4ME117010--5.977768.5572
PE (38:6)PE 38:6ME117011--5.126764.5258
PE (p-36:2) or PE (o-36:3)PE P-36:2 or PE O-36:3ME117012--6.413728.5582
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME117013--5.607724.5276
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME117014--6.274752.5584
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME117015--5.596750.5433
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME117016--6.197778.5731
SM (d32:1)SM 32:1;O2ME117017--4.315675.543
SM (d33:1)SM 33:1;O2ME117018--4.6235689.5588
SM (d34:0)SM 34:0;O2ME117019--5.058705.5867
SM (d34:1)SM 34:1;O2ME117020--4.9385703.5748
SM (d34:2)SM 34:2;O2ME117021--4.413701.5587
SM (d36:0)SM 36:0;O2ME117022--5.859733.6202
SM (d36:1)SM 36:1;O2ME117023--5.6195731.606
SM (d36:2)SM 36:2;O2ME117024--5.0595729.5882
SM (d38:1)SM 38:1;O2ME117025--6.325759.6364
SM (d39:1)SM 39:1;O2ME117026--6.672773.648
SM (d40:0)SM 40:0;O2ME117027--7.263789.6811
SM (d40:1)SM 40:1;O2ME117028--7.0175787.6679
SM (d41:1)SM 41:1;O2ME117029--7.35801.6835
SM (d41:2)SM 41:2;O2ME117030--6.656799.6667
SM (d42:1)SM 42:1;O2ME117031--7.6905815.6996
SM (d42:2)SM 42:2;O2ME117032--6.99813.6842
TG (42:1)TG 42:1ME117033--9.212743.6197
TG (46:0)TG 46:0ME117034--10.659796.7393
TG (46:1)TG 46:1ME117035--10.2155799.678
TG (46:2)TG 46:2ME117036--9.795792.7079
TG (48:0) ATG 48:0ME117037--11.077829.7261
TG (48:0) BTG 48:0ME117038--11.226824.7707
TG (48:1)TG 48:1ME117039--10.661827.7105
TG (48:2)TG 48:2ME117040--10.265825.694
TG (48:3)TG 48:3ME117041--9.83823.6792
TG (49:0)TG 49:0ME117042--11.264838.7862
TG (49:1)TG 49:1ME117043--10.8795836.7714
TG (49:2)TG 49:2ME117044--10.495834.7542
TG (50:0)TG 50:0ME117045--11.569857.7571
TG (50:1)TG 50:1ME117046--11.069855.7418
TG (50:2)TG 50:2ME117047--10.699853.7276
TG (50:3)TG 50:3ME117048--10.3015851.7101
TG (50:4)TG 50:4ME117049--9.8995844.7387
TG (50:5)TG 50:5ME117050--9.509842.7229
TG (51:1)TG 51:1ME117051--11.273864.8014
TG (51:2)TG 51:2ME117052--10.9085862.7865
TG (51:3)TG 51:3ME117053--10.521860.7698
TG (51:4)TG 51:4ME117054--10.146858.7537
TG (52:0)TG 52:0ME117055--11.818880.8323
TG (52:1)TG 52:1ME117056--11.465883.7728
TG (52:2)TG 52:2ME117057--11.0975881.7574
TG (52:3)TG 52:3ME117058--10.729879.7431
TG (52:4)TG 52:4ME117059--10.356877.7263
TG (52:5)TG 52:5ME117060--9.9865875.7103
TG (52:6)TG 52:6ME117061--9.568873.6955
TG (53:1)TG 53:1ME117062--11.6335892.8321
TG (53:2)TG 53:2ME117063--11.291890.8123
TG (53:3)TG 53:3ME117064--10.93888.8016
TG (53:4)TG 53:4ME117065--10.567886.7854
TG (53:5)TG 53:5ME117066--10.193884.7686
TG (54:1)TG 54:1ME117067--11.8015906.8482
TG (54:2)TG 54:2ME117068--11.486904.8323
TG (54:3)TG 54:3ME117069--11.1375902.8161
TG (54:4)TG 54:4ME117070--10.776900.7996
TG (54:5)TG 54:5ME117071--10.3915898.7842
TG (54:6)TG 54:6ME117072--10.0015901.7258
TG (54:7)TG 54:7ME117073--9.6325894.7547
TG (55:3)TG 55:3ME117074--11.31916.8321
TG (56:1)TG 56:1ME117075--11.9645934.8792
TG (56:2)TG 56:2ME117076--11.8015932.8645
TG (56:3)TG 56:3ME117077--11.491930.8479
TG (56:4)TG 56:4ME117078--11.154933.7908
TG (56:5)TG 56:5ME117079--10.847931.7804
TG (56:6)TG 56:6ME117080--10.6485929.7572
TG (56:7)TG 56:7ME117081--10.285927.7413
TG (56:8)TG 56:8ME117082--10.0415920.7687
TG (58:1)TG 58:1ME117083--12.064967.867
TG (58:10)TG 58:10ME117084--9.6615944.7703
TG (58:2)TG 58:2ME117085--11.968960.8933
TG (58:3)TG 58:3ME117086--11.8175958.8806
TG (58:4)TG 58:4ME117087--11.492956.8634
TG (58:6)TG 58:6ME117088--10.882957.7923
TG (58:8) ATG 58:8ME117089--10.481953.7575
TG (58:8) BTG 58:8ME117090--10.116948.7935
TG (58:9)TG 58:9ME117091--10.0645946.7851
TG (60:2)TG 60:2ME117092--12.0725988.9274


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Ceramide (d33:1)Cer 33:1;O2ME117131--5.559558.4651
Ceramide (d34:0)Cer 34:0;O2ME117132--6.153598.5356
Ceramide (d34:1)Cer 34:1;O2ME117133--5.97572.4825
Ceramide (d38:1)Cer 38:1;O2ME117134--7.314628.5436
Ceramide (d40:1)Cer 40:1;O2ME1171355283567-8.002656.5748
Ceramide (d41:1)Cer 41:1;O2ME117136--8.338670.5904
Ceramide (d42:1)Cer 42:1;O2ME1171375283571-8.6355708.6501
Ceramide (d42:2)Cer 42:2;O2ME1171385283568-7.9665682.5928
FA (18:1) (oleic acid)Oleic acidME117139445639C007122.816281.2487
FA (20:1) (eicosenoic acid)Eicosenoic acidME117140--3.399309.2797
FA (20:3) (homo-gamma-linolenic acid)Dihomo-gamma-linolenic acidME1171415280581C032422.481305.249
FA (20:4) (arachidonic acid)Arachidonic acidME117142444899C002192.032303.233
FA (20:5) (eicosapentaenoic acid)Eicosapentaenoic acidME117143446284C064281.591301.2173
FA (22:6) (docosahexaenoic acid)Docosahexaenoic acidME117144445580C064291.814327.2329
FA (24:0) (lignoceric acid)Lignoceric acidME11714511197C083205.371367.3576
GlcCer(d14:1(4E)/20:0(2OH))GlcCer 14:1;O2(4E)/20:0;OME11714670699246-5.079774.5725
LPC (16:0)LPC 16:0ME117147460602C042301.654554.3458
LPC (18:0)LPC 18:0ME117148--2.468582.3772
PC (34:1)PC 34:1ME117149--5.815818.5909
PC (34:2)PC 34:2ME117150--5.311816.5755
PC (36:1)PC 36:1ME117151--6.499846.6226
PC (36:2)PC 36:2ME117152--5.975844.6065
PC (36:3)PC 36:3ME117153--5.398842.5907
PC (36:4)PC 36:4ME117154--5.205840.5753
PC (36:5)PC 36:5ME117155--4.796838.5596
PC (38:3)PC 38:3ME117156--6.159870.6223
PC (38:4)PC 38:4ME117157--5.877868.6068
PC (38:5)PC 38:5ME117158--5.393866.5908
PC (38:6)PC 38:6ME117159--5.05864.5754
PC (40:6)PC 40:6ME117160--5.685892.6066
PE (34:1)PE 34:1ME117161--5.958716.523
PE (34:2)PE 34:2ME117162--5.439714.5066
PE (36:2)PE 36:2ME117163--6.122742.5388
PE (36:3)PE 36:3ME117164--5.51740.5228
PE (36:4)PE 36:4ME117165--5.332738.5076
PE (38:4)PE 38:4ME117166--6.002766.5391
PE (38:6)PE 38:6ME117167--5.184762.5077
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME117168--5.63722.5123
PE (p-38:3) or PE (o-38:4)PE P-38:3 or PE O-38:4ME117169--6.444752.5592
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME117170--6.33750.5439
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME117171--5.678748.5282
PE (p-40:4) or PE (o-40:5)PE P-40:4 or PE O-40:5ME117172--7.002778.577
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME117173--6.24776.5594
PE (p-40:6) or PE (o-40:7)PE P-40:6 or PE O-40:7ME117174--6.119774.5436
SM (d34:1)SM 34:1;O2ME117175--4.992761.58
SM (d36:1)SM 36:1;O2ME117176--5.689789.6114
SM (d40:1)SM 40:1;O2ME117177--7.1845.6741
SM (d42:1)SM 42:1;O2ME117178--7.765873.7057
SM (d42:2)SM 42:2;O2ME117179--7.055871.6902


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