3-Butylidene-1(3H)-isobenzofuranone (CHEBI:196485)

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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	3-Butylidene-1(3H)-isobenzofuranone

ChEBI ID	CHEBI:196485

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H12O2

Net Charge

Average Mass

188.226

Monoisotopic Mass

188.08373

InChI

InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+

InChIKey

WMBOCUXXNSOQHM-DHZHZOJOSA-N

SMILES

O1/C(/C=2C(C1=O)=CC=CC2)=C/CCC

ChEBI Ontology
Outgoing	3-Butylidene-1(3H)-isobenzofuranone (CHEBI:196485) is a isobenzofuranone (CHEBI:55372)

IUPAC Name

(3E)-3-butylidene-2-benzouran-1-one