Molecular properties
- Formula
- C4H7N
- Molar mass
- 69.11 g·mol−1
- Exact mass
- 69.0578 Da
- 2
- PubChem CID
- 6559
Molecule record
2-methylpropanenitrile
C4H7N
69.11 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1-Cyano-1-methylethane
- 2-Cyanopropane
- 2-Methylpropane nitrile
- 2-Methylpropionitrile
- 201-147-5
- 699AWF2WV2
- 78-82-0
- CHEBI:28638
Show all 24 synonyms
- DTXCID606461
- DTXSID5026461
- Dimethylacetonitrile
- ISOBUTANENITRILE
- Isobutyronitrile
- Isopropyl cyanide
- Isopropyl nitrile
- Isopropylkyanid
- Isopropylnitrile
- NSC-60536
- Propanenitrile, 2-methyl-
- Propanoic acid, 2-methyl-, nitrile
- RefChem:149123
- UN-2284
- UN2284
- alpha-Methylpropanenitrile
Structure identifiers
- Canonical SMILES
- CC(C)C#N
- Isomeric SMILES
- CC(C)C#N
- InChI
- InChI=1S/C4H7N/c1-4(2)3-5/h4H,1-2H3
- InChIKey
- LRDFRRGEGBBSRN-UHFFFAOYSA-N
- PubChem CID
- 6559
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 2-methylpropanenitrile; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-methylpropanenitrile; not experimental data.
Sources
Molecule identity
Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.