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CAS Number: 1261726-80-0
3-oxoisoindoline-5-carbonitrile

Structure

 3-oxoisoindoline-5-carbonitrile
Name: 3-oxoisoindoline-5-carbonitrile
Synonyms:
General Information
Product Number: 1261726800

CAS Registry Number 1261726-80-0
Name:
1H-?Isoindole-?5-?carbonitrile, 2,?3-?dihydro-?3-?oxo-

 

Chemical Formula: C9H6N2O
Exact Mass: 158.05
Molecular Weight: 158.16
m/z: 158.05 (100.0%), 159.05 (10.6%)

 

InChI:InChI=1S/C9H6N2O/c10-4-6-1-2-7-5-11-9(12)8(7)3-6/h1-3H,5H2,(H,11,12)

InChI Key:OBXKDLJQBYJDHR-UHFFFAOYSA-N

Canonical SMILES:C1C2=C(C=C(C=C2)C#N)C(=O)N1

Specification

98%
References
  1. (1) Kumar, C. Kishor; Journal of Pharmaceutical Science & Technology 2010, V2(12), P380-390 CAPLUS
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