Molecular properties
- Formula
- C9H8O2
- Molar mass
- 148.16 g·mol−1
- Exact mass
- 148.0524 Da
- 6
- PubChem CID
- 643436
Molecule record
3-acetylbenzaldehyde
C9H8O2
148.16 g/mol
Loading structure
Functional groups
Aldehyde
Alkane / alkyl carbon
Aromatic ring
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1-(3-formylphenyl)-ethanone
- 3'-FORMYLACETOPHENONE
- 3-ACETYLBENZALDEHYDE 97
- 3-Acetylbenzaldehyde 95%
- 3-acetyl-benzaldehyde
- 41908-11-6
- AKOS006222300
- AS-57375
Show all 24 synonyms
- Benzaldehyde, 3-acetyl- (9CI)
- CHEBI:203900
- CL9709
- CS-0204479
- DB-029161
- DTXCID60300250
- DTXSID50349178
- MFCD05865161
- RefChem:1067264
- SCHEMBL1482839
- SCHEMBL29957449
- SCHEMBL5389398
- SY104252
- XH1279
- benzaldehyde, 3-acetyl-
- m-formylacetophenone
Structure identifiers
- Canonical SMILES
- CC(=O)c1cccc(C=O)c1
- Isomeric SMILES
- CC(=O)C1=CC=CC(=C1)C=O
- InChI
- InChI=1S/C9H8O2/c1-7(11)9-4-2-3-8(5-9)6-10/h2-6H,1H3
- InChIKey
- QVNFUJVNBRCKNJ-UHFFFAOYSA-N
- PubChem CID
- 643436
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3-acetylbenzaldehyde; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-acetylbenzaldehyde; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.