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Analysis: ESI negative ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Adenosine triphosphateATPME6850335957C00002--
Nicotinamide Adenine Dinucleotide oxidizedNAD+ME68503910897651C00003--
Nicotinamide Adenine Dinucleotide reducedNADHME685040439153C00004--
Dihydronicotinamide-adenine dinucleotide phosphateNADPHME6850425884C00005--
Nicotinamide adenine dinucleotide phosphateNADP+ME6850415886C00006--
Adenosine diphosphateADPME6850316022C00008--
Flavin adenine dinucleotideFADME685036643975C00016--
Adenosine monophosphateAMPME6850326083C00020--
Acetyl-CoAAcetyl-CoAME685030444493C00024--
PhosphoenolpyruvatePhosphoenolpyruvic acidME6850431005C00074--
SucroseSucroseME6850445988C00089--
Glucose 6-phosphate or fructose-6-phosphateGlucose 6-phosphateME6850355958C00092--
MalateMalic acidME685038222656C00149--
Citrate or IsocitrateCitric acid/Isocitric acidME685034311C00158--
6-Phosphogluconate6-Phosphogluconic acidME68502991493C00345--
Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME685037172313C00354--
2 or 3-phosphoglyceratePhosphoglyceric acidME685028724C00597--


Analysis: EI positive ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
PyruvatePyruvic acidME6850451060C00022--
alpha-Ketoglutarate2-Oxoglutaric acidME68505051C00026--
OxaloacetateOxaloacetic acidME685049970C00036--
AlanineAlanineME6850475950C00041--
AspartateAspartic acidME6850515960C00049--
GlutamineGlutamineME6850535961C00064--
FumarateFumaric acidME685048444972C00122--
LactateLactic acidME685046107689C00186--
GlutamateGlutamic acidME685052611---


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