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Molecule record

5-methoxy-1H-indole

C9H9NO

147.18 g/mol

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Molecular properties

Formula
C9H9NO
Molar mass
147.18 g·mol−1
Exact mass
147.0684 Da
6
PubChem CID
13872

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ether

Physical properties

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

Common names and synonyms

  • 1006-94-6
  • 1H-Indole, 5-methoxy-
  • 213-745-3
  • 5-METHOXYINDOLE
  • 5-Methoxy indole
  • 5-Methoxyindole, 99%
  • 5-methoxyindol
  • 5Methoxyindole
Show all 24 synonyms
  • BDBM50400288
  • BZ3
  • CHEBI:167807
  • CHEMBL280311
  • DQM3AS43PQ
  • DTXCID2065915
  • DTXSID80143424
  • Femedol
  • Indol-5-yl methyl ether
  • Indole, 5-methoxy-
  • M0731
  • MFCD00005674
  • Methoxy-5 indole
  • NSC-521752
  • RefChem:103062
  • Z104507276

Structure identifiers

Canonical SMILES
COc1ccc2[nH]ccc2c1
Isomeric SMILES
COC1=CC2=C(C=C1)NC=C2
InChI
InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3
InChIKey
DWAQDRSOVMLGRQ-UHFFFAOYSA-N
PubChem CID
13872

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 5-methoxy-1H-indole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 5-methoxy-1H-indole; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record