Molecular properties
- Formula
- C13H12O3
- Molar mass
- 216.24 g·mol−1
- Exact mass
- 216.0786 Da
- 8
- PubChem CID
- 23616528
Molecule record
6-hydroxy-6-phenylcyclohexa-2,4-diene-1-carboxylic acid
C13H12O3
216.24 g/mol
Loading structure
Functional groups
Alcohol
Alkane / alkyl carbon
Alkene
Aromatic ring
Carboxylic acid
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2-phenylsalicylic acid
- SCHEMBL574722
Structure identifiers
- Canonical SMILES
- O=C(O)C1C=CC=CC1(O)c1ccccc1
- Isomeric SMILES
- C1=CC=C(C=C1)C2(C=CC=CC2C(=O)O)O
- InChI
- InChI=1S/C13H12O3/c14-12(15)11-8-4-5-9-13(11,16)10-6-2-1-3-7-10/h1-9,11,16H,(H,14,15)
- InChIKey
- DNBLGPUTKNZNSP-UHFFFAOYSA-N
- PubChem CID
- 23616528
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 6-hydroxy-6-phenylcyclohexa-2,4-diene-1-carboxylic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 6-hydroxy-6-phenylcyclohexa-2,4-diene-1-carboxylic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.