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Analysis: Reversed phase UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
FA (10:0) (capric acid) [M-H]-Capric acidME292500--0.73-
FA (11:0) (undecylic acid) [M-H]-Undecylic acidME292501--0.93-
FA (12:0) (lauric acid) [M-H]-Lauric acidME292502--1.44-
FA (14:0) (myristic acid) [M-H]-Myristic acidME292503--0.94-
FA (14:1) (physeteric acid) [M-H]--ME292504--1.7-
FA (15:0) (pentadecylic acid) [M-H]-Pentadecylic acidME292505--2.23-
FA (16:0) (palmitic acid) [M-H]-Palmitic acidME292506--1.47-
FA (16:1) (palmitoleic acid) [M-H]-Palmitoleic acidME292507--2.72-
FA (17:0) (margaric acid) [M-H]-Margaric acidME292508--3.11-
FA (18:0) (stearic acid) [M-H]-Stearic acidME292509--2.44-
FA (18:1) (oleic acid) [M-H]-Oleic acidME292510--1.84-
FA (18:2) (linoleic acid) [M-H]-Linoleic acidME292511--1.42-
FA (18:3) (linolenic acid) [M-H]-Octadecatrienoic acidME292512--3.21-
FA 19:0; [M-H]-Nonadecylic acidME292519--1.53-
FA 20:0; [M-H]-Arachidic acidME292520--0.53-
FA (20:1) (eicosenoic acid) [M-H]-cis-Gondoic acidME292513--2.76-
FA (20:2) (eicosadienoic acid) [M-H]-11Z,14Z-Eicosadienoic acidME292514--2.26-
FA (20:3) (eicosatrienoic acid) A [M-H]-Eicosatrienoic acidME292515--2.12-
FA (20:3) (homo-gamma-linolenic acid) B [M-H]-Bishomo-gamma-linolenic acidME292516--1.72-
FA (20:4) (arachidonic acid) [M-H]-Arachidonic acidME292517--1.32-
FA (20:5) (eicosapentaenoic acid) [M-H]-Eicosapentaenoic acidME292518--3.34-
FA 22:0; [M-H]-Behenic acidME292523--4.28-
FA 22:1; [M-H]-Docosenoic acidME292524--3.72-
FA (22:2) (docosadienoic acid) [M-H]-Docosadienoic acidME292521--3.4-
FA 22:3; [M-H]-Docosatrienoic acidME292525--3.02-
FA (22:6) (docosahexaenoic acid) [M-H]-Docosahexaenoic acidME292522--3.67-
FA (8:0) (caprylic acid) [M-H]-Caprylic acidME292499--0.65-
LPC(14:0) [M+H]+LPC 14:0ME292576--0.89-
LPC(15:0) [M+H]+LPC 15:0ME292577--1.09-
LPC(16:0) [M+H]+LPC 16:0ME292578--1.36-
LPC(16:1) [M+H]+LPC 16:1ME292579--1-
LPC(18:1) [M+H]+LPC 18:1ME292580--1.5-
LPC(18:2) [M+H]+LPC 18:2ME292581--1.12-
LPC(18:3) [M+H]+LPC 18:3ME292582--0.9-
LPC (20:0) [M+H]+LPC 20:0ME292569--2.96-
LPC (20:2) [M+H]+LPC 20:2ME292570--1.68-
LPC(20:3) [M+H]+LPC 20:3ME292583--1.3-
LPC(20:4) [M+H]+LPC 20:4ME292584--1.02-
LPC(20:5) [M+H]+LPC 20:5ME292585--0.87-
LPC (22:4) [M+H]+LPC 22:4ME292571--1.53-
LPC(22:5) [M+H]+LPC 22:5ME292586--1.19-
LPC (22:6) [M+H]+LPC 22:6ME292572--1.05-
LPC (o-16:0) [M+H]+LPC O-16:0ME292573--1.57-
LPC (p-16:0) or LPC (o-16:1) [M+H]+LPC P-16:0 or LPC O-16:1ME292574--1.54-
LPC (p-18:0) or LPC (o-18:1) [M+H]+LPC P-18:0 or LPC O-18:1ME292575--1.75-
LPE (16:0) [M-H]-LPE 16:0ME292526--1.35-
LPE (18:2) [M-H]-LPE 18:2ME292527--1.06-
LPE (20:4) [M-H]-LPE 20:4ME292528--1.03-
LPE (22:6) [M-H]-LPE 22:6ME292529--1.05-
LysoPC 18:0; [M+H]+LPC(18:0)ME292587--2.08-
LysoPE 18:0; [M-H]-LPE(18:0)ME292530--2.09-
LysoPE 22:4; [M-H]-LPE(22:4)ME292531--1.42-
PC (16:0/9:0(CHO)) [M+H]+-ME292588--2.21-
PC(28:0) [M+H]+PC 28:0ME292623--4.17-
PC(30:0) [M+H]+PC 30:0ME292624--4.72-
PC 30:1; PC(14:0/16:1); [M+H]+PC 14:0_16:1ME292601--4.31-
PC 30:2; PC(15:1/15:1); [M+H]+PC 15:1/15:1ME292602--4.05-
PC(31:0) [M+H]+PC 31:0ME292625--5.01-
PC(31:1) [M+H]+PC 31:1ME292626--4.58-
PC(32:0) [M+H]+PC 32:0ME292627--5.32-
PC 32:0; PC(16:0/16:0) A; [M+H]+PC 16:0/16:0ME292603--5.44-
PC 32:0; PC(16:0/16:0) B; [M+H]+PC 16:0/16:0ME292604--5.56-
PC(32:1) [M+H]+PC 32:1ME292628--4.8-
PC 32:1; PC(16:0/16:1); [M+H]+PC 16:0_16:1ME292605--5-
PC(32:2) [M+H]+PC 32:2ME292629--4.36-
PC 32:2; PC(16:0/16:2); [M+H]+PC 16:0_16:2ME292606--4.62-
PC (32:3) [M+H]+PC 32:3ME292589--4.71-
PC 32:3; PC(16:0/16:3); [M+H]+PC 16:0/16:3ME292607--4.27-
PC 32:3; PC(16:1/16:2); [M+H]+PC 16:1_16:2ME292608--4.2-
PC(33:0) [M+H]+PC 33:0ME292630--5.64-
PC(33:1) [M+H]+PC 33:1ME292631--5.09-
PC(33:2) [M+H]+PC 33:2ME292632--4.64-
PC(34:0) [M+H]+PC 34:0ME292633--5.95-
PC(34:1) [M+H]+PC 34:1ME292634--5.395-
PC(34:2) [M+H]+PC 34:2ME292635--4.93-
PC 34:2; PC(17:1/17:1); [M+H]+PC 17:1/17:1ME292609--5.04-
PC(34:3) A [M+H]+PC 34:3ME292636--4.49-
PC(34:3) C [M+H]+PC 34:3ME292637--4.63-
PC(34:4) [M+H]+PC 34:4ME292638--4.28-
PC(35:1) [M+H]+PC 35:1ME292639--5.71-
PC 35:1; PC(17:0/18:1); [M+H]+PC 17:0_18:1ME292610--5.6-
PC(35:2) A [M+H]+PC 35:2ME292640--5.2-
PC(35:3) [M+H]+PC 35:3ME292641--4.76-
PC(35:4) [M+H]+PC 35:4ME292642--4.56-
PC 36:0; PC(18:0/18:0); [M+H]+PC 18:0/18:0ME292611--6.59-
PC(36:1) [M+H]+PC 36:1ME292643--6.03-
PC(36:2) [M+H]+PC 36:2ME292644--5.48-
PC(36:3) A [M+H]+PC 36:3ME292645--5-
PC(36:3) B [M+H]+PC 36:3ME292646--5.09-
PC 36:3; PC(16:0/20:3); [M+H]+PC 16:0_20:3ME292612--5.27-
PC(36:4) A [M+H]+PC 36:4ME292647--4.57-
PC(36:4) B [M+H]+PC 36:4ME292648--4.73-
PC(36:4) C [M+H]+PC 36:4ME292649--4.84-
PC(36:5)A [M+H]+PC 36:5ME292652--4.21-
PC(36:5) C [M+H]+PC 36:5ME292650--4.37-
PC(36:5) D [M+H]+PC 36:5ME292651--4.47-
PC(36:6) [M+H]+PC 36:6ME292653--4.14-
PC (37:3) [M+H]+PC 37:3ME292590--5.29-
PC(37:4) [M+H]+PC 37:4ME292654--5.14-
PC(37:5) [M+H]+PC 37:5ME292655--4.72-
PC(38:1) [M+H]+PC 38:1ME292656--6.6-
PC(38:2) [M+H]+PC 38:2ME292657--6.07-
PC(38:3) [M+H]+PC 38:3ME292658--5.72-
PC 38:3; PC(18:0/20:3); [M+H]+PC 18:0_20:3ME292613--5.9-
PC 38:3; PC(18:1/20:2); [M+H]+PC 18:1_20:2ME292614--5.6-
PC(38:4) A [M+H]+PC 38:4ME292659--5.15-
PC(38:4) B [M+H]+PC 38:4ME292660--5.27-
PC(38:4) C [M+H]+PC 38:4ME292661--5.45-
PC(38:5) A [M+H]+PC 38:5ME292662--4.9-
PC(38:5) B [M+H]+PC 38:5ME292663--5.05-
PC 38:5; PC(16:1/22:4); [M+H]+PC 16:1_22:4ME292615--4.76-
PC(38:6) A [M+H]+PC 38:6ME292664--4.485-
PC(38:6) B [M+H]+PC 38:6ME292665--4.7-
PC(38:6) C [M+H]+PC 38:6ME292666--5.01-
PC(38:7) [M+H]+PC 38:7ME292667--4.27-
PC (39:6) [M+H]+PC 39:6ME292591--4.97-
PC 40:3; PC(18:0/22:3); [M+H]+PC 18:0_22:3ME292616--6.37-
PC 40:3; PC(18:1/22:2); [M+H]+PC 18:1_22:2ME292617--6.21-
PC(40:4) [M+H]+PC 40:4ME292668--5.89-
PC 40:4; PC(18:1/22:3); [M+H]+PC 18:1_22:3ME292618--5.79-
PC(40:5) A [M+H]+PC 40:5ME292669--5.48-
PC(40:5) B [M+H]+PC 40:5ME292670--5.69-
PC 40:5; PC(18:1/22:4); [M+H]+PC 18:1_22:4ME292619--5.33-
PC(40:6) A [M+H]+PC 40:6ME292671--4.98-
PC(40:6) B [M+H]+PC 40:6ME292672--5.28-
PC(40:7) A [M+H]+PC 40:7ME292673--4.62-
PC(40:7) B [M+H]+PC 40:7ME292674--4.76-
PC(40:8) [M+H]+PC 40:8ME292675--4.37-
PC(42:10) [M+H]+PC 42:10ME292676--4.26-
PC (42:5) [M+H]+PC 42:5ME292592--5.91-
PC 42:5; PC(22:1/20:4); [M+H]+PC 20:4_22:1ME292620--6.08-
PC (42:6) [M+H]+PC 42:6ME292593--5.63-
PC 42:7; PC(22:3/20:4); [M+H]+PC 22:3/20:4ME292621--5.21-
PC 44:8; PC(22:4/22:4); [M+H]+PC 22:4/22:4ME292622--5.23-
PC(o-32:0) [M+H]+PC O-32:0ME292677--5.69-
PC(o-34:0) [M+H]+PC O-34:0ME292678--6.35-
PC (p-32:0) or PC (o-32:1) [M+H]+PC P-32:0 or PC O-32:1ME292594--5.6-
PC(p-32:1)/PC(o-32:2) [M+H]+PC P-32:1 or PC O-32:2ME292679--4.75-
PC(p-34:1)/PC(o-34:2) [M+H]+PC P-34:1 or PC O-34:2ME292680--5.28-
PC(p-34:2)/PC(o-34:3) [M+H]+PC P-34:2 or PC O-34:3ME292681--5.18-
PC(p-36:1)/PC(o-36:2) B [M+H]+PC P-36:1 or PC O-36:2ME292682--6.32-
PC (p-36:3) or PC (o-36:4) [M+H]+PC P-36:3 or PC O-36:4ME292595--5.18-
PC(p-36:4)/PC(o-36:5) [M+H]+PC P-36:4 or PC O-36:5ME292683--5.08-
PC(p-36:5)/PC(o-36:6) [M+H]+PC P-36:5 or PC O-36:6ME292684--4.71-
PC (p-38:2) or PC (o-38:3) [M+H]+PC P-38:2 or PC O-38:3ME292596--6.1-
PC(p-38:3)/PC(o-38:4) A [M+H]+PC P-38:3 or PC O-38:4ME292685--5.64-
PC(p-38:3)/PC(o-38:4) B [M+H]+PC P-38:3 or PC O-38:4ME292686--5.82-
PC(p-38:4)/PC(o-38:5) A [M+H]+PC P-38:4 or PC O-38:5ME292687--5.23-
PC(p-38:4)/PC(o-38:5) B [M+H]+PC P-38:4 or PC O-38:5ME292688--5.71-
PC(p-38:5)/PC(o-38:6) A [M+H]+PC P-38:5 or PC O-38:6ME292689--5.02-
PC(p-38:5)/PC(o-38:6) B [M+H]+PC P-38:5 or PC O-38:6ME292690--5.14-
PC(p-38:6)/PC(o-38:7) [M+H]+PC P-38:6 or PC O-38:7ME292691--4.92-
PC (p-40:1) or PC (o-40:2) [M+H]+PC P-40:1 or PC O-40:2ME292597--6.52-
PC(p-40:3)/PC(o-40:4) [M+H]+PC P-40:3 or PC O-40:4ME292692--6.47-
PC(p-40:4)/PC(o-40:5) [M+H]+PC P-40:4 or PC O-40:5ME292693--5.84-
PC(p-40:5)/PC(o-40:6) [M+H]+PC P-40:5 or PC O-40:6ME292694--5.73-
PC(p-40:6)/PC(o-40:7) A [M+H]+PC P-40:6 or PC O-40:7ME292695--5.06-
PC(p-40:6)/PC(o-40:7) B [M+H]+PC P-40:6 or PC O-40:7ME292696--5.46-
PC (p-40:7) or PC (o-40:8) [M+H]+PC P-40:7 or PC O-40:8ME292598--4.99-
PC (p-42:3) or PC (o-42:4) [M+H]+PC P-42:3 or PC O-42:4ME292599--7.18-
PC(p-42:4)/PC(o-42:5) [M+H]+PC P-42:4 or PC O-42:5ME292697--6.5-
PC(p-42:5)/PC(o-42:6) A [M+H]+PC P-42:5 or PC O-42:6ME292698--5.89-
PC(p-42:5)/PC(o-42:6) B [M+H]+PC P-42:5 or PC O-42:6ME292699--6.35-
PC(p-44:4)/PC(o-44:5) [M+H]+PC P-44:4 or PC O-44:5ME292700--7.07-
PC (p-44:5) or PC (o-44:6)PC P-44:5 or PC O-44:6ME292600--6.96-
PE 32:0; PE(16:0/16:0); [M-H]-PE 16:0/16:0ME292537--5.46-
PE 32:1; PE(16:0/16:1); [M-H]-PE 16:0_16:1ME292538--4.96-
PE 32:2; PE(16:0/16:2); [M-H]-PE 16:0/16:2ME292539--4.74-
PE 34:1; PE(16:0/18:1); [M-H]-PE 16:0_18:1ME292540--5.53-
PE (34:2) [M-H]-PE 34:2ME292532--5.39-
PE 34:2; PE(16:0/18:2); [M-H]-PE 16:0_18:2ME292541--5.06-
PE 34:3; PE(16:0/18:3); [M-H]-PE 16:0_18:3ME292542--4.74-
PE 36:2; PE(18:1/18:1); [M-H]-PE 18:1/18:1ME292543--5.61-
PE (36:3) [M-H]-PE 36:3ME292533--5.41-
PE 36:3; PE(18:1/18:2); [M-H]-PE 18:1_18:2ME292544--5.12-
PE 36:4; PE(16:0/20:4); [M-H]-PE 16:0_20:4ME292545--4.95-
PE 36:5; PE(16:0/20:5); [M-H]-PE 16:0_20:5ME292546--4.58-
PE 38:1; PE(18:0/20:1); [M-H]-PE 18:0_20:1ME292547--6.76-
PE 38:2; PE(18:0/20:2); [M-H]-PE 18:0_20:2ME292548--6.38-
PE 38:2; PE(18:1/20:1); [M-H]-PE 18:1_20:1ME292549--6.21-
PE 38:3; PE(18:0/20:3) A; [M-H]-PE 18:0_20:3ME292550--5.85-
PE 38:3; PE(18:0/20:3) B; [M-H]-PE 18:0_20:3ME292551--6.04-
PE 38:4; PE(18:0/20:4); [M-H]-PE 18:0/20:4ME292552--5.58-
PE 38:4; PE(18:1/20:3); [M-H]-PE 18:1_20:3ME292553--5.42-
PE 38:5; PE(18:0/20:5); [M-H]-PE 18:0_20:5ME292554--5.18-
PE 38:5; PE(18:1/20:4); [M-H]-PE 18:1_20:4ME292555--5.03-
PE 38:6; PE(16:0/22:6); [M-H]-PE 16:0/22:6ME292556--4.77-
PE 40:2; PE(18:0/22:2); [M-H]-PE 18:0_22:2ME292557--6.91-
PE 40:2; PE(18:1/22:1); [M-H]-PE 18:1_22:1ME292558--6.8-
PE 40:3; PE(18:0/22:3); [M-H]-PE 18:0_22:3ME292559--6.51-
PE 40:4; PE(18:0/22:4); [M-H]-PE 18:0_22:4ME292560--6.03-
PE 40:4; PE(18:1/22:3); [M-H]-PE 18:1_22:3ME292561--5.94-
PE 40:5; PE(18:0/22:5) A; [M-H]-PE 18:0_22:5ME292562--5.61-
PE 40:5; PE(18:0/22:5) B; [M-H]-PE 18:0_22:5ME292563--5.81-
PE 40:5; PE(18:1/22:4); [M-H]-PE 18:1_22:4ME292564--5.46-
PE 40:6; PE(18:0/22:6); [M-H]-PE 18:0_22:6ME292565--5.41-
PE 42:1; PE(24:0/18:1); [M-H]-PE 18:1_24:0ME292566--8.05-
PE 42:2; PE(18:1/24:1); [M-H]-PE 18:1_24:1ME292567--7.41-
PE 42:5; PE(22:1/20:4); [M-H]-PE 20:4_22:1ME292568--6.22-
PE (p-38:3) or PE (o-38:4) [M-H]-PE P-38:3 or PE O-38:4ME292534--6.17-
PE (p-40:4) or PE (o-40:5) [M-H]-PE P-40:4 or PE O-40:5ME292535--6.23-
PE (p-40:5) or PE (o-40:6) [M-H]-PE P-40:5 or PE O-40:6ME292536--6.12-


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