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Analysis: GC UNSPECIFIED ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,5-anhydroglucitol1,5-AnhydrosorbitolME418406---633603
1-monopalmitinMG 16:0/0:0/0:0ME418405---901749
1-monostearinMG 18:0/0:0/0:0ME418404---959214
2,3-dihydroxybutanoic acid NIST2,3-Dihydroxybutanoic acidME418403---384796
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME418402---397526
2-aminobutyric acid2-Aminobutyric acidME418401---285825
2-deoxytetronic acid3,4-Dihydroxybutyric acidME418400---433456
2-hydroxyglutaric acid2-Hydroxyglutaric acidME418399---506306
2-ketobutyric acid3-Methyl pyruvic acidME418398---225358
2-ketoisocaproic acidKetoleucineME418397---310761
2-monooleinMG 0:0/18:1(9Z)/0:0ME418396---941794
3,6-anhydro-D-galactose3,6-Anhydro-galactoseME418395---588886
3-hydroxybutyric acid3-Hydroxybutyric acidME418394---278632
3-phosphoglycerate3-Phosphoglyceric acidME418393---610734
4-aminobutyric acid4-Aminopentanoic acidME418392---488730
4-hydroxybutyric acid4-Hydroxybutyric acidME418391---325027
5-aminovaleric acid5-Aminopentanoic acidME418390---536657
5-methoxytryptamine5-MethoxytryptamineME418389---864466
aconitic acidcis-Aconitic acidME418388---584528
adenosineAdenosineME418387---918039
adenosine-5-monophosphateAMPME418386---1041375
adipic acidAdipic acidME418385---474435
alanineAlanineME418384---243971
allantoic acidAllantoic acidME418383---726050
alpha-aminoadipic acidalpha-Aminoadipic acidME418382---574115
alpha-ketoglutarate2-Oxoglutaric acidME418381---507392
aminomalonateAminomalonic acidME418380---455754
arabinoseArabinoseME418379---550621
arabitolArabitolME418378---570685
arachidic acidArachidic acidME418377---856421
arachidonic acidArachidonic acidME418376---834339
asparagineAsparagineME418375---553078
aspartic acidAspartic acidME418374---480387
behenic acidBehenic acidME418373---920648
benzoic acidBenzoic acidME418372---338990
beta-alaninebeta-AlanineME418371---435564
beta-glycerolphosphatesn-Glycero-2-phosphateME418370---574470
beta-sitosterolSitosterolME418369---1128225
cellobioseCellobioseME418368---932179
cholesterolCholesterolME418367---1078536
cholesteroneCholestenoneME418366---1095940
cis-gondoic acidcis-Gondoic acidME418365---847372
citric acidCitric acidME418364---617342
citrullineCitrullineME418363---621404
conduritol-beta-epoxideConduritol epoxideME418362---675635
creatinineCreatinineME418361---502599
cysteineCysteineME418360---500158
cystineCystineME418359---804619
deoxypentitol1-Deoxy-D-ribitolME418358---528774
dihydrocholesterolDihydrocholesterolME418357---1082070
docosahexaenoic acidDocosahexaenoic acidME418356---902819
erythronic acidErythronic acidME418355---512029
ethanolamineEthanolamineME418354---343800
fructoseFructoseME418353---639442
fructose-1-phosphateFructose 1-phosphateME418352---803180
fructose-6-phosphateFructose 6-phosphateME418351---804279
fucoseFucoseME418350---584895
fumaric acidFumaric acidME418349---392338
galactonic acidGalactonic acidME418348---690882
galactose-6-phosphateGalactose 6-phosphateME418347---828102
galacturonic acidGalacturonic acidME418346---678231
gluconic acidGluconic acidME418345---693148
glucoseGlucoseME418344---678811
glucose-1-phosphateGlucose 1-phosphateME418343---597071
glucose-6-phosphateGlucose 6-phosphateME418342---818275
glutamic acidGlutamic acidME418341---529100
glutamineGlutamineME418340---600315
glutaric acidGlutaric acidME418339---421596
glutathioneGlutathioneME418338---761296
glyceric acidGlyceric acidME418337---377495
glycerolGlycerolME418336---344466
glycerol-3-galactosideGalactosylglycerolME418335---800205
glycerol-alpha-phosphatesn-Glycero-3-phosphateME418334---590747
glycineGlycineME418333---368707
glycolic acidGlycolic acidME418332---227636
heptadecanoic acidMargaric acidME418331---751309
hexitolSorbitolME418330---704741
hexose-6-phosphateHexose 6-phosphateME418329---806282
hexuronic acidHexuronic acidME418328---673957
histidineHistidineME418327---663739
hydrocinnamic acidHydrocinnamic acidME418326---434422
hydroxycarbamate NISTHydroxycarbamic acidME418325---325318
hypoxanthineHypoxanthineME418324---619128
indole-3-acetateIndoleacetic acidME418323---684929
indole-3-lactateIndolelactic acidME418322---764586
indole-3-propionic acid3-Indolepropionic acidME418321---732249
indoxyl sulfateIndoxyl sulfateME418320---577333
inosineInosineME418319---897184
inosine-5'-monophosphateIMPME418318---1018687
inositol-4-monophosphateInositol 4-phosphateME418317---846510
isocitric acidIsocitric acidME418316---617338
isohexonic acid-ME418315---698302
isoleucineIsoleucineME418314---359251
isomaltoseIsomaltoseME418313---983199
isoriboseD-RibopyranoseME418312---558730
isothreonic acidD-Threonic acidME418311---489385
lactic acidLactic acidME418310---217657
lactitolLactitolME418309---959541
lactoseLactoseME418308---935640
leucineLeucineME418307---346357
levoglucosanGlucosanME418306---569637
linoleic acidLinoleic acidME418305---777414
linolenic acidOctadecatrienoic acidME418304---780376
lysineLysineME418303---663483
lyxitolL-ArabitolME418302---573587
lyxoseLyxoseME418301---541086
malic acidMalic acidME418300---463180
maltoseMaltoseME418299---946601
maltotriitol-ME418298---1216941
maltotrioseMaltotrioseME418297---1176044
mannoseMannoseME418296---645856
melezitoseMelezitoseME418295---1146704
methanolphosphateMethanolphosphateME418294---289520
methionineMethionineME418293---483560
methionine sulfoxideMethionine sulfoxideME418292---637588
methylmalonic acidMethylmalonic acidME418291---311617
myo-inositolMyo-inositolME418290---730022
myristic acidMyristic acidME418289---634414
n-acetyl-d-hexosamineN-AcetylhexosamineME418288---746341
N-acetyl-D-tryptophanN-Acetyl-D-tryptophanME418287---859454
N-acetylglutamateN-Acetylglutamic acidME418286---604748
N-acetylmannosamineN-Acetyl-mannosamineME418285---735323
nicotinamideNiacinamideME418284---469827
oleamide NISTOleamideME418283---849710
oleic acidOleic acidME418282---781527
ornithineOrnithineME418281---527113
oxalic acidOxalic acidME418280---260513
oxoprolineOxoprolineME418279---485935
palmitic acidPalmitic acidME418278---713809
palmitoleic acidPalmitoleic acidME418277---704511
pantothenic acidPantothenic acidME418276---690887
phenylalaninePhenylalanineME418275---537804
phenylethylaminePhenylethylamineME418274---510327
phosphatePhosphoric acidME418273---345365
phosphoethanolaminePhosphoethanolamineME418272---603912
phosphogluconic acidPhosphogluconic acidME418271---847013
pinitolPinitolME418270---622466
pipecolinic acidPipecolic acidME418269---404121
prolineProlineME418268---366784
pseudo uridinePseudouridineME418267---813899
putrescinePutrescineME418266---588119
pyrophosphatePyrophosphateME418265---327517
raffinoseRaffinoseME418264---1120886
ribitolRibitolME418263---575497
ribonic acidRibonic acidME418262---597646
riboseRiboseME418261---553135
serineSerineME418260---395020
sophoroseSophoroseME418259---965726
sorbitolSorbitolME418258---667922
stearic acidStearic acidME418257---787622
succinic acidSuccinic acidME418256---370608
sucroseSucroseME418255---912704
tagatoseD-TagatoseME418254---636627
taurineTaurineME418253---558857
threonic acidThreonic acidME418252---497572
threonineThreonineME418251---408777
thymidineThymidineME418250---349402
thymineThymineME418249---420133
tocopherol alpha-alpha-TocopherolME418248---1067809
trans-4-hydroxy-L-prolinetrans-4-HydroxyprolineME418247---459475
tryptophanTryptophanME418246---780482
tyrosineTyrosineME418245---671252
UDP-glucuronic acidUDP-glucuronic acidME418244---585473
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME418243---623789
uracilUracilME418242---385816
ureaUreaME418241---290193
uric acidUric acidME418240---731038
uridineUridineME418239---861508
valineValineME418238---313502
xanthineXanthineME418237---701688
xanthosineXanthosineME418236---926133
xylitolXylitolME418235---567437
xylonic acid isomer-ME418234---590775
xylonolactone NISTD-Xylono-1,5-lactoneME418233---535176
xyloseXyloseME418232---544100


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