CHEBI:195935 - alpha,alpha-Dimethylanisalacetone

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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 alpha,alpha-Dimethylanisalacetone
ChEBI ID CHEBI:195935
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O2
Net Charge 0
Average Mass 204.269
Monoisotopic Mass 204.11503
InChI InChI=1S/C13H16O2/c1-10(2)13(14)9-6-11-4-7-12(15-3)8-5-11/h4-10H,1-3H3/b9-6+
InChIKey ZIXVMEYRFPMOAV-RMKNXTFCSA-N
SMILES O=C(C(C)C)/C=C/C1=CC=C(OC)C=C1
ChEBI Ontology
Outgoing alpha,alpha-Dimethylanisalacetone (CHEBI:195935) is a methoxybenzenes (CHEBI:51683)
IUPAC Name
(E)-1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
Manual Xrefs Databases
4523733 ChemSpider
HMDB0030904 HMDB
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