Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-19 15:45:18 UTC
Update Date2024-10-17 15:09:05 UTC
Metabolite IDMMDBc0047839
Metabolite Identification
Common Name(+/-)-Glycerol 1,2-diacetate
Description(±)-Glycerol 1,2-diacetate is a solvent; used for decaffeinating coffe
Structure
Synonyms
ValueSource
(±)-glycerol 1,2-diacetic acidGenerator
1,2-DiacylglycerolMeSH
1,2,3-Propanetriol, 1,2-diacetateHMDB
1,2-DiacetinHMDB
1,2-DiacetylglycerolHMDB
Glycerol 1,2-diacetateHMDB
Molecular FormulaC7H12O5
Average Mass176.1672
Monoisotopic Mass176.068473494
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C7H12O5/c1-5(9)11-4-7(3-8)12-6(2)10/h7-8H,3-4H2,1-2H3
InChI KeyUXDDRFCJKNROTO-UHFFFAOYSA-N