Phenethyl tiglate (CHEBI:195940)

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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	Phenethyl tiglate

ChEBI ID	CHEBI:195940

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H16O2

Net Charge

Average Mass

204.269

Monoisotopic Mass

204.11503

InChI

InChI=1S/C13H16O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h3-8H,9-10H2,1-2H3/b11-3+

InChIKey

KVMWYGAYARXPOL-QDEBKDIKSA-N

SMILES

O(CCC1=CC=CC=C1)C(=O)/C(/C)=C/C

ChEBI Ontology
Outgoing	Phenethyl tiglate (CHEBI:195940) is a fatty acid ester (CHEBI:35748)

IUPAC Name

2-phenylethyl (E)-2-methylbut-2-enoate