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Molecule record

1,2-oxazole-4-carbonitrile

C4H2N2O

94.07 g/mol

Loading structure

Molecular properties

Formula
C4H2N2O
Molar mass
94.07 g·mol−1
Exact mass
94.0167 Da
5
PubChem CID
15590756

Functional groups

Nitrile

Physical properties

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

Common names and synonyms

  • 4-CYANOISOXAZOLE
  • 68776-58-9
  • AKOS006275525
  • CS-0312434
  • DB-003476
  • DTXCID40526072
  • DTXSID60575300
  • F2167-2710
Show all 17 synonyms
  • ISOXAZOLE-4-CARBONITRILE
  • MB01145
  • MFCD00274091
  • RefChem:216401
  • SCHEMBL1995631
  • SCHEMBL2040319
  • SCHEMBL2044879
  • SCHEMBL6180858
  • s11668

Structure identifiers

Canonical SMILES
N#Cc1cnoc1
Isomeric SMILES
C1=C(C=NO1)C#N
InChI
InChI=1S/C4H2N2O/c5-1-4-2-6-7-3-4/h2-3H
InChIKey
ONJYXAHBSGPICV-UHFFFAOYSA-N
PubChem CID
15590756

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 1,2-oxazole-4-carbonitrile; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1,2-oxazole-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