CHEBI:203900 - 1-(3-Formylphenyl)-ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 1-(3-Formylphenyl)-ethanone
ChEBI ID CHEBI:203900
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H8O2
Net Charge 0
Average Mass 148.161
Monoisotopic Mass 148.05243
InChI InChI=1S/C9H8O2/c1-7(11)9-4-2-3-8(5-9)6-10/h2-6H,1H3
InChIKey QVNFUJVNBRCKNJ-UHFFFAOYSA-N
SMILES O=C(C1=CC(=CC=C1)C=O)C
Metabolite of Species Details
Boletus edulis (NCBI:txid36056) See: PubMed
ChEBI Ontology
Outgoing 1-(3-Formylphenyl)-ethanone (CHEBI:203900) is a aromatic ketone (CHEBI:76224)
IUPAC Name
3-acetylbenzaldehyde
Manual Xref Database
558581 ChemSpider
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