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Molecule record

cinnoline-4-carbonitrile

C9H5N3

155.16 g/mol

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Molecular properties

Formula
C9H5N3
Molar mass
155.16 g·mol−1
Exact mass
155.0483 Da
9
PubChem CID
593257

Functional groups

Aromatic ring
Nitrile

Physical properties

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

Common names and synonyms

  • 16470-90-9
  • 4-Cinnolinecarbonitrile
  • 4-Cinnolinecarbonitrile #
  • 4-Cyanocinnoline
  • AKOS022635340
  • CS-0090447
  • DB-349191
  • DS-9970
Show all 13 synonyms
  • DTXSID80343927
  • F14411
  • F611002
  • MFCD16657481
  • SCHEMBL2013659

Structure identifiers

Canonical SMILES
N#Cc1cnnc2ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C(=CN=N2)C#N
InChI
InChI=1S/C9H5N3/c10-5-7-6-11-12-9-4-2-1-3-8(7)9/h1-4,6H
InChIKey
SKALQBBFRXNOBD-UHFFFAOYSA-N
PubChem CID
593257

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 cinnoline-4-carbonitrile; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for cinnoline-4-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