CHEBI:179908 - 4-Phenyl-2-butyl acetate

ChEBI IDCHEBI:179908
ChEBI Name4-Phenyl-2-butyl acetate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O2
Net Charge0
Average Mass192.258
Monoisotopic Mass192.11503
SMILESCC(=O)OC(C)CCc1ccccc1
InChIInChI=1S/C12H16O2/c1-10(14-11(2)13)8-9-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChIKeyIVEWTAOGAGBQGG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Phenyl-2-butyl acetate (CHEBI:179908) is a benzenes (CHEBI:22712)
IUPAC Name 
4-phenylbutan-2-yl acetate
Manual XrefsDatabases
55437ChemSpider
HMDB0031614HMDB
Registry NumbersSources
CAS:10415-88-0ChemIDplus