Isoallylbenzene (CHEBI:229144)

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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	Isoallylbenzene

ChEBI ID	CHEBI:229144

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H10

Net Charge

Average Mass

118.179

Monoisotopic Mass

118.07825

InChI

InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+

InChIKey

QROGIFZRVHSFLM-QHHAFSJGSA-N

SMILES

C1(=CC=CC=C1)/C=C/C

Metabolite of Species	Details
Zea mays (NCBI:txid4577)	Found in exometabolome See: MetaboLights Study

ChEBI Ontology
Outgoing	Isoallylbenzene (CHEBI:229144) is a styrenes (CHEBI:26799)

IUPAC Name

[(E)-prop-1-enyl]benzene