Molecule record

1H-indole-3-carboxylic acid

C9H7NO2

161.16 g/mol

Loading structure

Molecular properties

Formula
C9H7NO2
Molar mass
161.16 g·mol−1
Exact mass
161.0477 Da
7
PubChem CID
69867

Functional groups

Aromatic ring
Carboxylic acid

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • .beta.-Indolylcarboxylic acid
  • 212-231-6
  • 3-Carboxyindole
  • 3-Indolecarboxylate
  • 3-Indolecarboxylic acid
  • 3-Indoleformate
  • 3-Indoleformic acid
  • 3-Indolylcarboxylate
Show all 24 synonyms
  • 3-Indolylcarboxylic acid
  • 59711R38B0
  • 771-50-6
  • CCG-266287
  • CHEBI:24809
  • DTXCID00150377
  • DTXSID50227886
  • EINECS 212-231-6
  • EN300-13123
  • F2147-0150
  • FS-1053
  • ICO
  • Indole-3-carboxylic acid
  • MFCD00005624
  • RefChem:923413
  • Tropisetron Hydrochloride EP Impurity B

Structure identifiers

Canonical SMILES
O=C(O)c1c[nH]c2ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C(=CN2)C(=O)O
InChI
InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
InChIKey
KMAKOBLIOCQGJP-UHFFFAOYSA-N
PubChem CID
69867

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1H-indole-3-carboxylic acid; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1H-indole-3-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.

Open source record
1H-indole-3-carboxylic acid - Formula, Structure | ChemArche