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Molecule record

1H-indole-7-carbonitrile

C9H6N2

142.16 g/mol

Loading structure

Molecular properties

Formula
C9H6N2
Molar mass
142.16 g·mol−1
Exact mass
142.0531 Da
8
PubChem CID
10898816

Functional groups

Aromatic ring
Nitrile

Physical properties

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

Common names and synonyms

  • 689-988-8
  • 7-Cyano-1H-indole
  • 7-Cyanoindole
  • 7-cyanoindole, AldrichCPR
  • 96631-87-7
  • AC-22689
  • AKOS005255107
  • AS-11396
Show all 24 synonyms
  • CS-W002693
  • DB-007202
  • DTXSID90447546
  • EN300-219176
  • F047693
  • FC09853
  • MFCD00800653
  • NTUHBYLZRBVHRS-UHFFFAOYSA-N
  • RefChem:438766
  • SCHEMBL1420318
  • SCHEMBL15156733
  • SCHEMBL29361477
  • SCHEMBL7278872
  • SY012219
  • Z1198155196
  • indole-7-nitrile

Structure identifiers

Canonical SMILES
N#Cc1cccc2cc[nH]c12
Isomeric SMILES
C1=CC2=C(C(=C1)C#N)NC=C2
InChI
InChI=1S/C9H6N2/c10-6-8-3-1-2-7-4-5-11-9(7)8/h1-5,11H
InChIKey
NTUHBYLZRBVHRS-UHFFFAOYSA-N
PubChem CID
10898816

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-7-carbonitrile; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1H-indole-7-carbonitrile; 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