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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,2,4-benzenetriol1,2,4-TrihydroxybenzeneME13282510787C02814-239
1-monostearinMG 18:0/0:0/0:0ME13282424699D01947-399
2-aminoadipic acidalpha-Aminoadipic acidME132823469C00956-260
2-hydroxyglutaric acid2-Hydroxyglutaric acidME13282243C02630-129
2-ketoisocaproic acidKetoleucineME13282170C00233-200
3-aminoisobutyric acid3-Aminoisobutanoic acidME13282064956C05145-248
3-phosphoglycerate3-Phosphoglyceric acidME132819724C00197-299
5'-deoxy-5'-methylthioadenosine5'-MethylthioadenosineME132818439176C00170-236
6-deoxyglucitol NIST6-DeoxyglucitolME132817151266--117
adenineAdenineME132816190C00147-264
adenosineAdenosineME13281560961C00212-236
alanineAlanineME1328145950C00041-116
alpha ketoglutaric acidOxoglutaric acidME13281351C00026-198
arachidic acidArachidic acidME13281210467C06425-117
asparagineAsparagineME132811236C00152-100
aspartic acidAspartic acidME1328105960C00049-232
behenic acidBehenic acidME1328098215C08281-117
benzoic acidBenzoic acidME132808243C00180-179
beta-alaninebeta-AlanineME132807239C00099-248
beta-sitosterolSitosterolME132806222284C01753-129
butylamine NISTButylamineME1328058007--174
capric acidCapric acidME1328042969C01571-117
cholesterolCholesterolME1328035997C00187-129
citramalic acidCitramalic acidME1328021081C00815-247
creatinineCreatinineME132801588C00791-115
cysteineCysteineME132800594C00097-220
cytidine-5-monophosphate NISTCMPME1327996131C00055-169
dehydroabietic acidDehydroabietic acidME13279894391C12078-239
dodecaneN-DodecaneME1327978182C08374-98
dodecanolDodecanolME1327968193C02277-243
elaidic acidElaidic acidME1327955282749C01712-339
erythritolErythritolME132794222285C00503-205
fructoseFructoseME1327935984C00095-307
fructose-6-phosphateFructose 6-phosphateME13279269507C00085-315
fumaric acidFumaric acidME132791444972C00122-245
galactose-6-phosphateGalactose 6-phosphateME13279099058C00446-387
gluconic acidGluconic acidME13278910690C00257-333
gluconic acid lactoneGluconolactoneME1327887027C00198-217
glucoseGlucoseME1327875793C00031-160
glucose-6-phosphateGlucose 6-phosphateME1327865958C00092-387
glutamic acidGlutamic acidME13278533032C00025-246
glutamineGlutamineME1327845961C00064-156
glutathioneGlutathioneME132783124886C00051-213
glycerol-alpha-phosphatesn-Glycero-3-phosphateME132782754C00093-299
glycerol-beta-phosphatesn-Glycero-2-phosphateME1327812526C02979-243
glycineGlycineME132780750C00037-174
glycolic acidGlycolic acidME132779757C00160-177
hexuronic acidHexuronic acidME13277819770757--333
homoserineHomoserineME13277712647C00263-218
hydroxylamineHydroxylamineME132776787C00192-146
idonic acid NIST-ME132775193325--333
inosineInosineME1327746021C00294-217
inositol-4-monophosphateInositol 4-phosphateME132772440043C03546-318
inositol myo-Myo-inositolME132773892C00137-305
isoleucineIsoleucineME1327716306C00407-158
isothreonic acidD-Threonic acidME132770151152--292
lactic acidLactic acidME132769612C00186-191
lathosterol NISTLathosterolME13276865728C01189-255
lauric acidLauric acidME1327673893C02679-117
leucineLeucineME1327666106C00123-158
lysineLysineME1327655962C00047-156
malic acidMalic acidME132764222656C00149-233
mannitolMannitolME1327636251C00392-103
mannoseMannoseME13276218950C00159-205
mannose-6-phosphate NISTMannose 6-phosphateME13276165127C00275-387
methanolphosphateMethanolphosphateME13276013130--241
methionineMethionineME1327596137C00073-176
methylhexadecanoic acidMethylhexadecanoic acidME13275810465--117
monopalmitin-1-glycerideMG 16:0/0:0/0:0ME13275714900--371
myristic acidMyristic acidME13275611005C06424-285
N-acetylaspartic acidN-Acetylaspartic acidME13275565065C01042-158
N-acetyl-D-mannosamineN-Acetyl-mannosamineME13275465150C00645-202
N-methylalanineN-MethylalanineME1327535288725C02721-130
octadecanolStearyl alcoholME1327528221D01924-327
oleic acidOleic acidME132751445639C00712-339
ornithineOrnithineME1327506262C00077-174
oxoprolinePyroglutamic acidME1327497405C01879-156
palmitic acidPalmitic acidME132748985C00249-313
pantothenic acidPantothenic acidME1327476613C00864-103
pelargonic acidPelargonic acidME1327468158C01601-117
phenylalaninePhenylalanineME1327456140C00079-218
phosphoethanolaminePhosphoethanolamineME1327441015C00346-100
phosphogluconic acid6-Phosphogluconic acidME13274391493C00345-299
phosphoric acidPhosphoric acidME1327421004C00009-314
p-hydroquinoneHydroquinoneME132741785C00530-239
prolineProlineME132740145742C00148-142
propane-1,3-diol NISTPropane-1,3-diolME13273910442C02457-177
putrescinePutrescineME1327381045C00134-174
pyrazine 2,5-dihydroxy NIST-ME13273715532987--241
pyrophosphatePyrophosphateME1327361023C00013-110
ribitolRibitolME132735827C00474-319
riboseRiboseME1327345779C00121-307
ribose-5-phosphateRibose 5-phosphateME13273377982C00117-315
ribulose-5-phosphateRibulose 5-phosphateME132732439184C00199-357
salicylaldehyde2-HydroxybenzaldehydeME1327316998C06202-193
serineSerineME1327295951C00065-204
sorbitolSorbitolME1327305780C00794-103
stearic acidStearic acidME1327285281C01530-117
succinic acidSuccinic acidME1327271110C00042-247
sucroseSucroseME1327265988C00089-271
tagatoseD-TagatoseME13272592092D09007-307
taloseTaloseME13272499459C06467-160
taurineTaurineME1327231123C00245-326
threonineThreonineME1327226288C00188-117
trans-4-hydroxyprolinetrans-4-HydroxyprolineME1327215810C01157-158
triethanolamineTriethanolamineME1327207618C06771-262
tryptophanTryptophanME1327196305C00078-202
tyrosineTyrosineME1327186057C00082-179
UDP GlcNAcUDP-N-acetylglucosamineME132717445675C00043-226
uracilUracilME1327161174C00106-99
ureaUreaME1327151176C00086-171
valineValineME1327146287C00183-144
zymosterolZymosterolME13271392746C05437-129


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