PENTYL BENZOATE (CHEBI:195048)

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ChEBI Ontology

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	PENTYL BENZOATE

ChEBI ID	CHEBI:195048

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H16O2

Net Charge

Average Mass

192.258

Monoisotopic Mass

192.11503

InChI

InChI=1S/C12H16O2/c1-2-3-7-10-14-12(13)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3

InChIKey

QKNZNUNCDJZTCH-UHFFFAOYSA-N

SMILES

O(CCCCC)C(=O)C1=CC=CC=C1

ChEBI Ontology
Outgoing	PENTYL BENZOATE (CHEBI:195048) is a benzoate ester (CHEBI:36054)

IUPAC Name

pentyl benzoate