CHEBI:195937 - Cinnamyl isobutyrate

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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 Cinnamyl isobutyrate
ChEBI ID CHEBI:195937
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H16O2
Net Charge 0
Average Mass 204.269
Monoisotopic Mass 204.11503
InChI InChI=1S/C13H16O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-9,11H,10H2,1-2H3/b9-6+
InChIKey KLKQSZIWHVEARN-RMKNXTFCSA-N
SMILES O(C(=O)C(C)C)C/C=C/C1=CC=CC=C1
ChEBI Ontology
Outgoing Cinnamyl isobutyrate (CHEBI:195937) is a styrenes (CHEBI:26799)
IUPAC Name
[(E)-3-phenylprop-2-enyl] 2-methylpropanoate
Manual Xref Database
4511740 ChemSpider
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Registry Number Type Source
103-59-3 CAS Registry Number ChemIDplus