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Molecule record

3-methoxy-1H-indole

C9H9NO

147.18 g/mol

Loading structure

Molecular properties

Formula
C9H9NO
Molar mass
147.18 g·mol−1
Exact mass
147.0684 Da
6
PubChem CID
13736886

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

  • 16712-55-3
  • 1H-Indole, 3-methoxy-
  • 3-methoxyindole
  • AKOS006352892
  • BS-49442
  • CHEMBL5181011
  • CS-0163683
  • DB-348357
Show all 18 synonyms
  • DTXCID30498810
  • DTXSID30548026
  • E76079
  • F690809
  • MFCD12924274
  • RefChem:280323
  • SCHEMBL1899742
  • SCHEMBL2071022
  • SCHEMBL4461026
  • SCHEMBL4832432

Structure identifiers

Canonical SMILES
COc1c[nH]c2ccccc12
Isomeric SMILES
COC1=CNC2=CC=CC=C21
InChI
InChI=1S/C9H9NO/c1-11-9-6-10-8-5-3-2-4-7(8)9/h2-6,10H,1H3
InChIKey
CKDZUORTXOCQNI-UHFFFAOYSA-N
PubChem CID
13736886

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

Simulated EI mass spectrum

On-demand educational fragmentation for 3-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