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CAS Number: 23996-53-4
3-(1H-imidazol-1-yl)propanenitrile

Structure

3-(1H-imidazol-1-yl)propanenitrile
Name: 3-(1H-imidazol-1-yl)propanenitrile
Synonyms:
General Information
Product Number: 23996534

CAS Registry Number 23996-53-4
Name:
1H-​Imidazole-​1-​propanenitrile
Imidazole-1-propionitrile (8CI)
1-(2-Cyanoethyl)imidazole
1-Cyanoethylimidazole

 

Chemical Formula: C6H7N3
Exact Mass: 121.06
Molecular Weight: 121.14
m/z: 121.06 (100.0%), 122.07 (6.6%), 122.06 (1.1%)

 

InChI:InChI=1S/C6H7N3/c7-2-1-4-9-5-3-8-6-9/h3,5-6H,1,4H2

InChI Key:XEQIISVRKIKCLQ-UHFFFAOYSA-N

Canonical SMILES:C1=CN(C=N1)CCC#N

Specification

98%

References

(5) Peppel, Tim; Acta Crystallographica, Section E: Structure Reports Online 2009, V65(10), Po2480 CAPLUS

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