CHEBI:179939 - Isopropyl 3-methylbutanoate

ChEBI IDCHEBI:179939
ChEBI NameIsopropyl 3-methylbutanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC8H16O2
Net Charge0
Average Mass144.214
Monoisotopic Mass144.11503
SMILESCC(C)CC(=O)OC(C)C
InChIInChI=1S/C8H16O2/c1-6(2)5-8(9)10-7(3)4/h6-7H,5H2,1-4H3
InChIKeyZOIRKXLFEHOVER-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isopropyl 3-methylbutanoate (CHEBI:179939) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
propan-2-yl 3-methylbutanoate
Manual XrefsDatabases
55775ChemSpider
HMDB0032046HMDB
LMFA07010922LIPID MAPS
Registry NumbersSources
CAS:32665-23-9ChemIDplus