Molecular properties
- Formula
- C13H16O
- Molar mass
- 188.27 g·mol−1
- Exact mass
- 188.1201 Da
- 6
- PubChem CID
- 98945
Molecule record
2-benzylcyclohexan-1-one
C13H16O
188.27 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Ketone
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (2RS)-2-phenylmethylcyclohexanone
- 2-(phenylmethyl)cyclohexanone
- 2-Benzylcyclohexanone
- 2-Benzylcyclohexanone, >=97%
- 2-benzyl cyclohexanone
- 2-benzyl-cyclohexan-1-one
- 213-420-6
- 946-33-8
Show all 24 synonyms
- AKOS005207035
- AS-76609
- Cyclohexanone, 2-(phenylmethyl)-
- DB-057515
- DTXCID10835264
- DTXSID501314740
- EINECS 213-420-6
- FB177295
- MFCD00051455
- NS00042842
- NSC 149930
- NSC149930
- RefChem:465685
- SCHEMBL28381223
- SCHEMBL4595
- ST50407924
Structure identifiers
- Canonical SMILES
- O=C1CCCCC1Cc1ccccc1
- Isomeric SMILES
- C1CCC(=O)C(C1)CC2=CC=CC=C2
- InChI
- InChI=1S/C13H16O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2
- InChIKey
- CUYLPYBYCYQGCE-UHFFFAOYSA-N
- PubChem CID
- 98945
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 2-benzylcyclohexan-1-one; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-benzylcyclohexan-1-one; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.