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Analysis: C18 NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
CerP 32:1; [M-H]-@5.19CerP 32:1;O2ME191769--5.19-
CerP 34:0; [M-H]-@6.17CerP 18:0;O2/16:0ME1917705283582-6.17-
CerP 34:1; [M-H]-@5.94CerP 34:1;O2ME191771--5.94-
CerP 34:2; [M-H]-@5.40CerP 34:2;O2ME191772--5.4-
CerP 38:1; [M-H]-@7.29CerP 38:1;O2ME191773--7.29-
CerP 41:1; [M-H]-@8.14CerP 41:1;O2ME191774--8.14-
CerP 42:1; [M-H]-@8.41CerP 42:1;O2ME191775--8.41-
CL 66:1; [M-2H](2-)@6.26CL 66:1ME191765--6.26-
CL 74:3; [M-2H](2-)@6.99CL 74:3ME191766--6.99-
CL 76:5; [M-2H](2-)@6.98CL 76:5ME191767--6.98-
CL 78:5; [M-2H](2-)@6.51CL 78:5ME191768--6.51-
FFA(16:0)Palmitic acidME191776----
FFA(18:0)Stearic acidME1917775281---
FFA(18:1)Oleic acidME191778----
FFA(18:2)Octadecadienoic acidME191779----
FFA(20:0)Arachidic acidME19178010467---
FFA(20:1)Heneicosenoic acidME191781----
FFA(20:2)Eicosadienoic acidME191782----
FFA(20:4) Arachidonic acidArachidonic acidME191783----
FFA(22:0)Behenic acidME1917848215---
FFA(22:1)Docosenoic acidME191785----
FFA(22:2)Docosadienoic acidME191786----
FFA(22:3)Docosatrienoic acidME191787----
FFA(24:0)Lignoceric acidME19178811197---
FFA(24:1)Tetracosenoic acidME191789----
FFA(24:2)Tetracosadienoic acidME191790----
FFA(24:3)Tetracosatrienoic acidME19179152921854---
lysoPE 16:0; [M-H]-@1.66LPE 16:0ME191898--1.66-
lysoPE 17:0; [M-H]-@2.08LPE 17:0ME19189952925149-2.08-
lysoPE 18:1; [M-H]-@1.80LPE 18:1ME191900--1.8-
lysoPE 20:1; [M-H]-@2.67LPE 20:1ME191901--2.67-
lysoPE 20:2; [M-H]-@2.09LPE 20:2ME191902--2.09-
lysoPE 20:3; [M-H]-@1.66LPE 20:3ME191903--1.66-
lysoPE 22:4; [M-H]-@1.90LPE 22:4ME191904--1.9-
lysoPE 22:5; [M-H]-@1.56LPE 22:5ME191905--1.56-
lysoPE 22:6; [M-H]-@1.32LPE 22:6ME191906--1.32-
N-(15Z-tetracosenoyl)-sphing-4-enine; [M-H]-@8.45Cer 18:1;O2/24:1ME1917925283568-8.45-
N-(docosanoyl)-sphing-4-enine; [M-H]-@8.43Cer 18:1;O2/22:0ME1917935283567-8.43-
N-(eicosanoyl)-sphing-4-enine; [M-H]-@7.95Cer 18:1;O2/20:0ME1917945283566-7.95-
N-(hexadecanoyl)-sphing-4-enine; [M-H]-@6.87Cer 18:1;O2/16:0ME1917955283564-6.87-
N-(octadecanoyl)-sphing-4-enine; [M-H]-@7.46Cer 18:1;O2/18:0ME1917965283565-7.46-
N-(octadecanoyl)-sphinganine; [M-H]-@7.64Cer 18:0;O2/18:0ME1917975283573-7.64-
N-(tetracosanoyl)-sphing-4-enine; [M-H]-@8.88Cer 18:1;O2/24:0ME1917985283571-8.88-
PA 34:1; [M-H]-@6.82PA 34:1ME191799--6.82-
PA 34:2; [M-H]-@6.28PA 34:2ME191800--6.28-
PA 34:3; [M-H]-@5.77PA 34:3ME191801--5.77-
PA 36:1; [M-H]-@7.51PA 36:1ME191802--7.51-
PA 36:3; [M-H]-@6.43PA 36:3ME191803--6.43-
PA 36:4; [M-H]-@6.20PA 36:4ME191804--6.2-
PA 36:5; [M-H]-@5.97PA 36:5ME191805--5.97-
PA 38:5; [M-H]-@6.05PA 38:5ME191806--6.05-
PA 38:6; [M-H]-@6.21PA 38:6ME191807--6.21-
PA 40:7; [M-H]-@6.23PA 40:7ME191808--6.23-
PC 26:0; [M-Ac-H]-@4.57PC 26:0ME191809--4.57-
PC 30:0; [M-Ac-H]-@6.04PC 30:0ME191810--6.04-
PC 31:0; [M-Ac-H]-@6.31PC 31:0ME191811--6.31-
PC 32:0; [M-Ac-H]-@6.75PC 32:0ME191812--6.75-
PC 32:1; [M-Ac-H]-@6.12PC 32:1ME191813--6.12-
PC 32:2; [M-Ac-H]-@5.73PC 32:2ME191814--5.73-
PC 33:1; [M-Ac-H]-@6.56PC 33:1ME191815--6.56-
PC 33:2; [M-Ac-H]-@6.08PC 33:2ME191816--6.08-
PC 34:1; [M-Ac-H]-@6.81PC 34:1ME191817--6.81-
PC 34:2; [M-Ac-H]-@6.30PC 34:2ME191818--6.3-
PC 34:3; [M-Ac-H]-@5.95PC 34:3ME191819--5.95-
PC 35:1; [M-Ac-H]-@7.13PC 35:1ME191820--7.13-
PC 35:2; [M-Ac-H]-@6.66PC 35:2ME191821--6.66-
PC 35:4; [M-Ac-H]-@6.08PC 35:4ME191822--6.08-
PC 36:1; [M-Ac-H]-@7.48PC 36:1ME191823--7.48-
PC 36:2; [M-Ac-H]-@6.98PC 36:2ME191824--6.98-
PC 36:3; [M-Ac-H]-@6.52PC 36:3ME191825--6.52-
PC 36:5; [M-Ac-H]-@5.83PC 36:5ME191826--5.83-
PC 36:6; [M-Ac-H]-@5.54PC 36:6ME191827--5.54-
PC 37:2; [M-Ac-H]-@7.34PC 37:2ME191828--7.34-
PC 37:4; [M-Ac-H]-@6.62PC 37:4ME191829--6.62-
PC 37:6; [M-Ac-H]-@5.86PC 37:6ME191830--5.86-
PC 38:2; [M-Ac-H]-@7.63PC 38:2ME191831--7.63-
PC 38:3; [M-Ac-H]-@7.25PC 38:3ME191832--7.25-
PC 38:5; [M-Ac-H]-@6.50PC 38:5ME191833--6.5-
PC 38:6; [M-Ac-H]-@6.14PC 38:6ME191834--6.14-
PC 38:7; [M-Ac-H]-@5.60PC 38:7ME191835--5.6-
PC 39:6; [M-Ac-H]-@6.54PC 39:6ME191836--6.54-
PC 40:3; [M-Ac-H]-@7.82PC 40:3ME191837--7.82-
PC 40:4; [M-Ac-H]-@7.47PC 40:4ME191838--7.47-
PC 40:5; [M-Ac-H]-@7.11PC 40:5ME191839--7.11-
PC 40:6; [M-Ac-H]-@6.77PC 40:6ME191840--6.77-
PC 42:10; [M-Ac-H]-@5.83PC 42:10ME191841--5.83-
PE 30:0; [M-H]-@5.40PE 30:0ME191842--5.4-
PE 32:0; [M-H]-@6.78PE 32:0ME191843--6.78-
PE 32:1; [M-H]-@6.27PE 32:1ME191844--6.27-
PE 33:0; [M-H]-@7.05PE 33:0ME191845--7.05-
PE 33:2; [M-H]-@6.11PE 33:2ME191846--6.11-
PE 34:1; [M-H]-@6.90PE 34:1ME191847--6.9-
PE 34:2; [M-H]-@6.46PE 34:2ME191848--6.46-
PE 34:3; [M-H]-@6.00PE 34:3ME191849--6-
PE 34:4; [M-H]-@5.75PE 34:4ME191850--5.75-
PE 35:0; [M-H]-@7.63PE 35:0ME191851--7.63-
PE 35:1; [M-H]-@6.55PE 35:1ME191852--6.55-
PE 35:2; [M-H]-@6.73PE 35:2ME191853--6.73-
PE 35:4; [M-H]-@6.09PE 35:4ME191854--6.09-
PE 36:0; [M-H]-@7.90PE 36:0ME191855--7.9-
PE 36:1; [M-H]-@7.48PE 36:1ME191856--7.48-
PE 36:2; [M-H]-@7.06PE 36:2ME191857--7.06-
PE 36:3; [M-H]-@6.58PE 36:3ME191858--6.58-
PE 36:5; [M-H]-@5.96PE 36:5ME191859--5.96-
PE 37:4; [M-H]-@6.66PE 37:4ME191860--6.66-
PE 38:1; [M-H]-@7.49PE 38:1ME191861--7.49-
PE 38:2; [M-H]-@6.94PE 38:2ME191862--6.94-
PE 38:3; [M-H]-@7.26PE 38:3ME191863--7.26-
PE 38:4; [M-H]-@7.03PE 38:4ME191864--7.03-
PE 38:5; [M-H]-@6.54PE 38:5ME191865--6.54-
PE 38:7; [M-H]-@5.75PE 38:7ME191866--5.75-
PE 40:2; [M-H]-@7.64PE 40:2ME191867--7.64-
PE 40:4; [M-H]-@7.46PE 40:4ME191868--7.46-
PE 40:6; [M-H]-@6.95PE 40:6ME191869--6.95-
PE 40:7; [M-H]-@6.43PE 40:7ME191870--6.43-
PE 40:8; [M-H]-@5.97PE 40:8ME191871--5.97-
PG 33:0; [M-H]-@6.07PG 33:0ME191872--6.07-
PG 34:1; [M-H]-@5.83PG 34:1ME191873--5.83-
PG 34:2; [M-H]-@5.45PG 34:2ME191874--5.45-
PG 35:0; [M-H]-@6.62PG 35:0ME191875--6.62-
PG 36:0; [M-H]-@6.89PG 36:0ME191876--6.89-
PG 36:1; [M-H]-@6.44PG 36:1ME191877--6.44-
PG 36:2; [M-H]-@6.02PG 36:2ME191878--6.02-
PG 36:3; [M-H]-@5.31PG 36:3ME191879--5.31-
PG 38:4; [M-H]-@6.05PG 38:4ME191880--6.05-
PI 34:1; [M-H]-@5.68PI 34:1ME191881--5.68-
PI 34:2; [M-H]-@5.22PI 34:2ME191882--5.22-
PI 35:1; [M-H]-@5.94PI 35:1ME191883--5.94-
PI 35:2; [M-H]-@5.58PI 35:2ME191884--5.58-
PI 36:1; [M-H]-@6.31PI 36:1ME191885--6.31-
PI 36:2; [M-H]-@5.88PI 36:2ME191886--5.88-
PI 36:3; [M-H]-@5.38PI 36:3ME191887--5.38-
PI 36:4; [M-H]-@5.22PI 36:4ME191888--5.22-
PI 38:3; [M-H]-@6.07PI 38:3ME191889--6.07-
PI 38:4; [M-H]-@5.84PI 38:4ME191890--5.84-
PI 38:5; [M-H]-@5.37PI 38:5ME191891--5.37-
PI 38:6; [M-H]-@5.13PI 38:6ME191892--5.13-
PI 40:4; [M-H]-@6.34PI 40:4ME191893--6.34-
PI 40:5; [M-H]-@5.99PI 40:5ME191894--5.99-
PI 40:6; [M-H]-@5.80PI 40:6ME191895--5.8-
plasmenyl-PE 32:0; [M-H]-@7.15PE P-32:0 or PE O-32:1ME191907--7.15-
plasmenyl-PE 32:1; [M-H]-@6.61PE P-32:1 or PE O-32:2ME191908--6.61-
plasmenyl-PE 34:0; [M-H]-@7.24PE P-34:0 or PE O-34:1ME191909--7.24-
plasmenyl-PE 34:2; [M-H]-@6.75PE P-34:2 or PE O-34:3ME191910--6.75-
plasmenyl-PE 34:3; [M-H]-@6.41PE P-34:3 or PE O-34:4ME191911--6.41-
plasmenyl-PE 36:0; [M-H]-@7.27PE P-36:0 or PE O-36:1ME191912--7.27-
plasmenyl-PE 36:1; [M-H]-@7.78PE P-36:1 or PE O-36:2ME191913--7.78-
plasmenyl-PE 36:2; [M-H]-@7.35PE P-36:2 or PE O-36:3ME191914--7.35-
plasmenyl-PE 36:3; [M-H]-@6.93PE P-36:3 or PE O-36:4ME191915--6.93-
plasmenyl-PE 36:5; [M-H]-@6.30PE P-36:5 or PE O-36:6ME191916--6.3-
plasmenyl-PE 38:1; [M-H]-@8.29PE P-38:1 or PE O-38:2ME191917--8.29-
plasmenyl-PE 38:2; [M-H]-@7.94PE P-38:2 or PE O-38:3ME191918--7.94-
plasmenyl-PE 38:3; [M-H]-@7.56PE P-38:3 or PE O-38:4ME191919--7.56-
plasmenyl-PE 38:4; [M-H]-@7.26PE P-38:4 or PE O-38:5ME191920--7.26-
plasmenyl-PE 40:2; [M-H]-@8.31PE P-40:2 or PE O-40:3ME191921--8.31-
plasmenyl-PE 40:3; [M-H]-@8.07PE P-40:3 or PE O-40:4ME191922--8.07-
plasmenyl-PE 40:5; [M-H]-@7.59PE P-40:5 or PE O-40:6ME191923--7.59-
plasmenyl-PE 40:6; [M-H]-@7.23PE P-40:6 or PE O-40:7ME191924--7.23-
plasmenyl-PE 42:4; [M-H]-@8.25PE P-42:4 or PE O-42:5ME191925--8.25-
plasmenyl-PE 42:5; [M-H]-@7.91PE P-42:5 or PE O-42:6ME191926--7.91-
plasmenyl-PE 42:6; [M-H]-@7.79PE P-42:6 or PE O-42:7ME191927--7.79-
PS 38:4; [M-H]-@6.05PS 38:4ME191896--6.05-
PS 40:6; [M-H]-@5.88PS 40:6ME191897--5.88-


Analysis: C18 POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
CE(16:0); [M+NH4]+@10.96CE 16:0ME191928246520-10.96-
CE(16:1); [M+NH4]+@10.67CE 16:1ME191929--10.67-
CE(18:1); [M+NH4]+@10.92CE 18:1ME1919305283632-10.92-
CE(18:2); [M+NH4]+@10.65CE 18:2ME1919315287939-10.65-
CE(18:3); [M+NH4]+@10.50CE 18:3ME1919326436907-10.5-
CE(20:3); [M+NH4]+@10.78CE 20:3ME19193314274976-10.78-
CE(20:4); [M+NH4]+@10.54CE 20:4ME1919346479222-10.54-
CE(20:5); [M+NH4]+@10.39CE 20:5ME19193510372299-10.39-
CE(22:6); [M+NH4]+@10.50CE 22:6ME19193614274978-10.5-
DG 30:1; [M+NH4]+@6.88DG 30:1ME191937--6.88-
DG 32:0; [M+NH4]+@7.94DG 32:0ME191938--7.94-
DG 32:1; [M+NH4]+@7.49DG 32:1ME191939--7.49-
DG 32:2; [M+NH4]+@7.06DG 32:2ME191940--7.06-
DG 33:1; [M+NH4]+@7.75DG 33:1ME191941--7.75-
DG 34:0; [M+NH4]+@8.41DG 34:0ME191942--8.41-
DG 34:2; [M+NH4]+@7.60DG 34:2ME191943--7.6-
DG 34:3; [M+NH4]+@7.18DG 34:3ME191944--7.18-
DG 35:1; [M+NH4]+@8.21DG 35:1ME191945--8.21-
DG 35:2; [M+NH4]+@7.83DG 35:2ME191946--7.83-
DG 36:0; [M+NH4]+@8.89DG 36:0ME191947--8.89-
DG 36:1; [M+NH4]+@8.49DG 36:1ME191948--8.49-
DG 36:2; [M+NH4]+@8.07DG 36:2ME191949--8.07-
DG 36:3; [M+NH4]+@7.69DG 36:3ME191950--7.69-
DG 36:4; [M+NH4]+@7.32DG 36:4ME191951--7.32-
DG 36:5; [M+NH4]+@6.93DG 36:5ME191952--6.93-
DG 38:3; [M+NH4]+@8.20DG 38:3ME191953--8.2-
DG 38:4; [M+NH4]+@7.92DG 38:4ME191954--7.92-
DG 38:5; [M+NH4]+@7.67DG 38:5ME191955--7.67-
DG 38:6; [M+NH4]+@7.28DG 38:6ME191956--7.28-
DG 40:6; [M+NH4]+@7.74DG 40:6ME191957--7.74-
lysoPC 14:0; [M+H]+@1.15LPC 14:0ME192121--1.15-
lysoPC 15:0; [M+H]+@1.23LPC 15:0ME19212224779458-1.23-
lysoPC 16:0; [M+H]+@1.62LPC 16:0ME192123--1.62-
lysoPC 16:1; [M+Na]+@1.18LPC 16:1ME192124--1.18-
lysoPC 17:1; [M+H]+@1.51LPC 17:1ME192125--1.51-
lysoPC 18:0; [M+H]+@2.43LPC 18:0ME192126--2.43-
lysoPC 18:1; [M+H]+@1.85LPC 18:1ME192127--1.85-
lysoPC 18:2; [M+H]+@1.38LPC 18:2ME192128--1.38-
lysoPC 18:3; [M+H]+@1.18LPC 18:3ME192129--1.18-
lysoPC 19:0; [M+H]+@2.96LPC 19:0ME19213024779472-2.96-
lysoPC 20:0; [M+H]+@3.44LPC 20:0ME19213124779473-3.44-
lysoPC 20:2; [M+H]+@2.04LPC 20:2ME19213252924053-2.04-
lysoPC 20:3; [M+Na]+@1.50LPC 20:3ME192133--1.5-
lysoPC 22:0; [M+H]+@4.36LPC 22:0ME19213424779479-4.36-
lysoPC 22:1; [M+H]+@3.48LPC 22:1ME192135--3.48-
lysoPC 22:4; [M+H]+@1.82LPC 22:4ME19213652924039-1.82-
lysoPC 22:5; [M+H]+@1.53LPC 22:5ME192137--1.53-
lysoPC 22:6; [M+H]+@1.31LPC 22:6ME19213810415542-1.31-
lysoPC 24:0; [M+H]+@5.27LPC 24:0ME19213924779481-5.27-
lysoPC 24:1; [M+H]+@4.40LPC 24:1ME19214053480477-4.4-
lysoPE 16:1; [M+H]+@1.23LPE 16:1ME192141--1.23-
lysoPE 18:0; [M+H]+@2.50LPE 18:0ME192142--2.5-
lysoPE 18:2; [M+H]+@1.35LPE 18:2ME192143--1.35-
lysoPE 20:4; [M+H]+@1.34LPE 20:4ME192144--1.34-
MG 17:0; [M+Li]+@3.16MG 17:0ME191958107036-3.16-
PC 28:0; [M+Na]+@5.34PC 28:0ME191959--5.34-
PC 30:1; [M+Na]+@5.54PC 30:1ME191960--5.54-
PC 32:3; [M+H]+@6.09PC 32:3ME191961--6.09-
PC 33:3; [M+Na]+@5.71PC 33:3ME191962--5.71-
PC 34:4; [M+H]+@6.18PC 34:4ME191963--6.18-
PC 34:5; [M+H]+@5.57PC 34:5ME191964--5.57-
PC 35:3; [M+Na]+@6.18PC 35:3ME191965--6.18-
PC 35:5; [M+H]+@6.10PC 35:5ME191966--6.1-
PC 36:4; [M+H]+@6.02PC 36:4ME191967--6.02-
PC 36:7; [M+H]+@5.58PC 36:7ME191968--5.58-
PC 37:5; [M+Na]+@6.08PC 37:5ME191969--6.08-
PC 37:7; [M+H]+@6.04PC 37:7ME191970--6.04-
PC 38:4; [M+H]+@6.99PC 38:4ME191971--6.99-
PC 38:8; [M+H]+@5.94PC 38:8ME191972--5.94-
PC 38:9; [M+H]+@5.57PC 38:9ME191973--5.57-
PC 40:10; [M+H]+@5.65PC 40:10ME191974--5.65-
PC 40:5; [M+H]+@7.69PC 40:5ME191975--7.69-
PC 40:7; [M+H]+@7.69PC 40:7ME191976--7.69-
PC 40:8; [M+H]+@6.64PC 40:8ME191977--6.64-
PC 41:4; [M+H]+@7.81PC 41:4ME191978--7.81-
PC 42:11; [M+H]+@5.86PC 42:11ME191979--5.86-
PC 42:4; [M+H]+@8.20PC 42:4ME191980--8.2-
PC 42:5; [M+H]+@8.27PC 42:5ME191981--8.27-
PC 42:8; [M+H]+@7.10PC 42:8ME191982--7.1-
PC 44:4; [M+H]+@8.78PC 44:4ME191983--8.78-
PE 36:2; [M+H]+@7.08PE 36:2ME191984--7.08-
PE 36:4; [M+H]+@6.40PE 36:4ME191985--6.4-
PE 38:6; [M+H]+@6.25PE 38:6ME191986--6.25-
PE 40:5; [M+H]+@7.11PE 40:5ME191987--7.11-
plasmenyl-PC 18:0; [M+Na]+@1.85LPC P-18:0 or LPC O-18:1ME192145--1.85-
plasmenyl-PC 20:0; [M+Na]+@2.61PC P-20:0 or PC O-20:1ME192146--2.61-
plasmenyl-PC 24:0; [M+Na]+@4.41PC P-24:0 or PC O-24:1ME192147--4.41-
plasmenyl-PC 36:3; [M+Na]+@6.77PC P-36:3 or PC O-36:4ME192148--6.77-
plasmenyl-PC 36:4; [M+Na]+@6.67PC P-36:4 or PC O-36:5ME192149--6.67-
plasmenyl-PC 38:3; [M+Na]+@7.17PC P-38:3 or PC O-38:4ME192150--7.17-
plasmenyl-PC 40:3; [M+Na]+@7.94PC P-40:3 or PC O-40:4ME192151--7.94-
plasmenyl-PC 42:4; [M+Na]+@8.07PC P-42:4 or PC O-42:5ME192152--8.07-
plasmenyl-PC 44:4; [M+Na]+@8.58PC P-44:4 or PC O-44:5ME192153--8.58-
plasmenyl-PE 34:1; [M+H]+@7.22PE P-34:1 or PE O-34:2ME192154--7.22-
plasmenyl-PE 36:4; [M+H]+@6.70PE P-36:4 or PE O-36:5ME192155--6.7-
plasmenyl-PE 38:5; [M+H]+@6.73PE P-38:5 or PE O-38:6ME192156--6.73-
plasmenyl-PE 38:6; [M+H]+@6.63PE P-38:6 or PE O-38:7ME192157--6.63-
plasmenyl-PE 40:4; [M+H]+@7.86PE P-40:4 or PE O-40:5ME192158--7.86-
SM 21:1; [M]+@1.35SM 21:1;O2ME191988--1.35-
SM 28:1; [M]+@3.60SM 28:1;O2ME191989--3.6-
SM 29:1; [M]+@4.03SM 29:1;O2ME191990--4.03-
SM 30:0; [M]+@4.73SM 30:0;O2ME19199146891775-4.73-
SM 30:1; [M+Na]+@4.41SM 30:1;O2ME191992--4.41-
SM 31:1; [M+Na]+@4.81SM 31:1;O2ME191993--4.81-
SM 32:0; [M]+@5.50SM 32:0;O2ME19199444260138-5.5-
SM 32:1; [M+Na]+@5.20SM 32:1;O2ME19199511433862-5.2-
SM 32:2; [M+Na]+@4.56SM 32:2;O2ME191996--4.56-
SM 33:1; [M+Na]+@5.55SM 33:1;O2ME19199752931139-5.55-
SM 33:2; [M]+@5.22SM 33:2;O2ME191998--5.22-
SM 34:1; [M]+@5.87SM 34:1;O2ME191999--5.87-
SM 34:2; [M]+@5.32SM 34:2;O2ME192000--5.32-
SM 35:1; [M]+@6.24SM 35:1;O2ME192001--6.24-
SM 35:2; [M+Na]+@5.75SM 35:2;O2ME192002--5.75-
SM 36:1; [M]+@6.57SM 36:1;O2ME19200344260139-6.57-
SM 37:1; [M]+@6.95SM 37:1;O2ME192004--6.95-
SM 37:2; [M]+@6.47SM 37:2;O2ME192005--6.47-
SM 38:1; [M]+@7.29SM 38:1;O2ME192006--7.29-
SM 38:4; [M]+@5.85SM 38:4;O2ME192007--5.85-
SM 39:1; [M]+@8.36SM 39:1;O2ME192008--8.36-
SM 39:2; [M]+@7.16SM 39:2;O2ME192009--7.16-
SM 39:4; [M]+@6.88SM 39:4;O2ME192010--6.88-
SM 40:1; [M]+@7.79SM 40:1;O2ME192011--7.79-
SM 40:2; [M]+@7.23SM 40:2;O2ME192012--7.23-
SM 40:4; [M]+@6.33SM 40:4;O2ME192013--6.33-
SM 41:1; [M+Na]+@8.15SM 41:1;O2ME192014--8.15-
SM 41:2; [M+Na]+@7.66SM 41:2;O2ME192015--7.66-
SM 42:1; [M]+@8.39SM 42:1;O2ME19201744260133-8.39-
SM 42:1; [M+Na]+@8.41SM 42:1;O2ME19201644260133-8.41-
SM 42:2; [M]+@7.86SM 42:2;O2ME192018--7.86-
SM 42:4; [M]+@6.99SM 42:4;O2ME192019--6.99-
SM 42:5; [M]+@6.60SM 42:5;O2ME192020--6.6-
SM 43:1; [M+Na]+@8.68SM 43:1;O2ME192021--8.68-
SM 43:2; [M]+@8.32SM 43:2;O2ME192022--8.32-
SM 43:5; [M]+@7.76SM 43:5;O2ME192023--7.76-
SM 44:1; [M]+@8.99SM 44:1;O2ME192024--8.99-
SM 44:2; [M]+@8.43SM 44:2;O2ME192025--8.43-
TG 40:0; [M+NH4]+@9.46TG 40:0ME192026--9.46-
TG 40:1; [M+NH4]+@9.16TG 40:1ME192027--9.16-
TG 42:0; [M+NH4]+@9.75TG 42:0ME192028--9.75-
TG 42:1; [M+NH4]+@9.51TG 42:1ME192029--9.51-
TG 44:1; [M+NH4]+@9.79TG 44:1ME192030--9.79-
TG 44:2; [M+NH4]+@9.54TG 44:2ME192031--9.54-
TG 46:0; [M+NH4]+@10.33TG 46:0ME192032--10.33-
TG 46:1; [M+NH4]+@10.07TG 46:1ME192033--10.07-
TG 46:2; [M+NH4]+@9.82TG 46:2ME192034--9.82-
TG 46:3; [M+NH4]+@9.61TG 46:3ME192035--9.61-
TG 48:0; [M+NH4]+@10.56TG 48:0ME192036--10.56-
TG 48:1; [M+NH4]+@10.32TG 48:1ME192037--10.32-
TG 48:2; [M+NH4]+@10.09TG 48:2ME192038--10.09-
TG 48:3; [M+NH4]+@9.87TG 48:3ME192039--9.87-
TG 49:0; [M+NH4]+@10.69TG 49:0ME192040--10.69-
TG 49:1; [M+NH4]+@10.47TG 49:1ME192041--10.47-
TG 49:2; [M+NH4]+@10.27TG 49:2ME192042--10.27-
TG 49:3; [M+NH4]+@10.04TG 49:3ME192043--10.04-
TG 50:0; [M+NH4]+@10.81TG 50:0ME192044--10.81-
TG 50:1; [M+NH4]+@10.55TG 50:1ME192045--10.55-
TG 50:2; [M+NH4]+@10.33TG 50:2ME192046--10.33-
TG 50:3; [M+NH4]+@10.13TG 50:3ME192047--10.13-
TG 50:4; [M+NH4]+@9.94TG 50:4ME192048--9.94-
TG 50:5; [M+NH4]+@9.74TG 50:5ME192049--9.74-
TG 51:1; [M+NH4]+@10.72TG 51:1ME192050--10.72-
TG 51:2; [M+NH4]+@10.52TG 51:2ME192051--10.52-
TG 51:3; [M+NH4]+@10.31TG 51:3ME192052--10.31-
TG 51:4; [M+NH4]+@10.13TG 51:4ME192053--10.13-
TG 52:0; [M+Na]+@11.04TG 52:0ME192055--11.04-
TG 52:0; [M+NH4]+@11.06TG 52:0ME192054--11.06-
TG 52:1; [M+NH4]+@10.79TG 52:1ME192056--10.79-
TG 52:2; [M+NH4]+@10.57TG 52:2ME192057--10.57-
TG 52:3; [M+NH4]+@10.38TG 52:3ME192058--10.38-
TG 52:4; [M+NH4]+@10.19TG 52:4ME192059--10.19-
TG 52:5; [M+NH4]+@10.00TG 52:5ME192060--10-
TG 52:6; [M+NH4]+@9.84TG 52:6ME192061--9.84-
TG 52:7; [M+NH4]+@9.64TG 52:7ME192062--9.64-
TG 53:1; [M+NH4]+@10.95TG 53:1ME192063--10.95-
TG 53:2; [M+NH4]+@10.74TG 53:2ME192064--10.74-
TG 53:3; [M+NH4]+@10.55TG 53:3ME192065--10.55-
TG 53:4; [M+NH4]+@10.36TG 53:4ME192066--10.36-
TG 53:5; [M+NH4]+@10.17TG 53:5ME192067--10.17-
TG 53:6; [M+NH4]+@10.00TG 53:6ME192068--10-
TG 54:0; [M+NH4]+@11.28TG 54:0ME192069--11.28-
TG 54:1; [M+NH4]+@11.06TG 54:1ME192070--11.06-
TG 54:2; [M+NH4]+@10.84TG 54:2ME192071--10.84-
TG 54:3; [M+NH4]+@10.64TG 54:3ME192072--10.64-
TG 54:4; [M+NH4]+@10.44TG 54:4ME192073--10.44-
TG 54:5; [M+NH4]+@10.24TG 54:5ME192074--10.24-
TG 54:6; [M+NH4]+@10.10TG 54:6ME192075--10.1-
TG 54:7; [M+NH4]+@9.92TG 54:7ME192076--9.92-
TG 54:8; [M+NH4]+@9.72TG 54:8ME192077--9.72-
TG 54:9; [M+NH4]+@9.49TG 54:9ME192078--9.49-
TG 55:1; [M+NH4]+@11.16TG 55:1ME192079--11.16-
TG 55:2; [M+NH4]+@10.97TG 55:2ME192080--10.97-
TG 55:3; [M+NH4]+@10.78TG 55:3ME192081--10.78-
TG 55:4; [M+NH4]+@10.58TG 55:4ME192082--10.58-
TG 55:6; [M+NH4]+@10.30TG 55:6ME192083--10.3-
TG 56:10; [M+NH4]+@9.68TG 56:10ME192085--9.68-
TG 56:11; [M+NH4]+@9.48TG 56:11ME192086--9.48-
TG 56:1; [M+NH4]+@11.30TG 56:1ME192084--11.3-
TG 56:2; [M+NH4]+@11.08TG 56:2ME192087--11.08-
TG 56:3; [M+NH4]+@10.89TG 56:3ME192088--10.89-
TG 56:4; [M+Na]+@10.74TG 56:4ME192090--10.74-
TG 56:4; [M+NH4]+@10.72TG 56:4ME192089--10.72-
TG 56:5; [M+NH4]+@10.56TG 56:5ME192091--10.56-
TG 56:6; [M+NH4]+@10.38TG 56:6ME192092--10.38-
TG 56:7; [M+NH4]+@10.18TG 56:7ME192093--10.18-
TG 56:8; [M+NH4]+@10.02TG 56:8ME192094--10.02-
TG 56:9; [M+NH4]+@9.83TG 56:9ME192095--9.83-
TG 57:5; [M+NH4]+@10.68TG 57:5ME192096--10.68-
TG 57:7; [M+NH4]+@10.37TG 57:7ME192097--10.37-
TG 58:10; [M+NH4]+@9.96TG 58:10ME192099--9.96-
TG 58:11; [M+NH4]+@9.77TG 58:11ME192100--9.77-
TG 58:12; [M+NH4]+@9.61TG 58:12ME192101--9.61-
TG 58:1; [M+NH4]+@11.57TG 58:1ME192098--11.57-
TG 58:2; [M+NH4]+@11.32TG 58:2ME192102--11.32-
TG 58:3; [M+NH4]+@11.12TG 58:3ME192103--11.12-
TG 58:4; [M+NH4]+@10.93TG 58:4ME192104--10.93-
TG 58:5; [M+NH4]+@10.79TG 58:5ME192105--10.79-
TG 58:6; [M+NH4]+@10.60TG 58:6ME192106--10.6-
TG 58:7; [M+NH4]+@10.43TG 58:7ME192107--10.43-
TG 58:8; [M+NH4]+@10.31TG 58:8ME192108--10.31-
TG 58:9; [M+NH4]+@10.16TG 58:9ME192109--10.16-
TG 60:10; [M+NH4]+@10.21TG 60:10ME192111--10.21-
TG 60:11; [M+NH4]+@10.09TG 60:11ME192112--10.09-
TG 60:12; [M+NH4]+@9.89TG 60:12ME192113--9.89-
TG 60:13; [M+NH4]+@9.67TG 60:13ME192114--9.67-
TG 60:1; [M+NH4]+@11.80TG 60:1ME192110--11.8-
TG 60:5; [M+NH4]+@11.05TG 60:5ME192115--11.05-
TG 60:9; [M+NH4]+@10.38TG 60:9ME192116--10.38-
TG 62:13; [M+NH4]+@9.92TG 62:13ME192117--9.92-
TG 62:14; [M+NH4]+@9.81TG 62:14ME192118--9.81-
TG 62:2; [M+NH4]+@11.88TG 62:2ME192119--11.88-
TG 64:17; [M+NH4]+@9.54TG 64:17ME1921209546534-9.54-


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