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isobutyl benzoate

Go to external page http://purl.obolibrary.org/obo/CHEBI_87500

A benzoate ester obtained by the formal condensation of benzoic acid with isobutanol.

Term info

Label

isobutyl benzoate

Synonyms
  • 2-methylpropyl benzoate
database cross reference
Subsets

3_STAR

IUPAC NAME
2-methylpropyl benzoate [ IUPAC ]

charge

0

formula

C11H14O2

has obo namespace

chebi_ontology

has related synonym

benzoic acid isobutyl ester

id

CHEBI:87500

inchi

InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3

inchikey

KYZHGEFMXZOSJN-UHFFFAOYSA-N

mass

178.22770

monoisotopicmass

178.09938

smiles

CC(C)COC(=O)c1ccccc1