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CAS Number: 37398-49-5
2-acetylisonicotinonitrile

Structure

2-acetylisonicotinonitrile
Name: 2-acetylisonicotinonitrile
Synonyms:
General Information
Product Number: 37398495
CAS Registry Number: 37398-49-5
Name:
        4-​Pyridinecarbonitrile​, 2-​acetyl-
        2-​Acetyl-​4-​cyanopyridine; 2-​Acetylisonicotinonit​rile 
 
Chemical Formula: C8H6N2O
Exact Mass: 146.05
Molecular Weight: 146.15
m/z: 146.05 (100.0%), 147.05 (9.5%)
Elemental Analysis: C, 65.75; H, 4.14; N, 19.17; O, 10.95
 
InChI: InChI=1S/C8H6N2O/c1-6(11)8-4-7(5-9)2-3-10-8/h2-4H,1H3
InChIKey: WISLYNBDMYWHNF-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=NC=CC(=C1)C#N

Specification

98%

References

PCT Int. Appl. (2013), WO 2013150416 A1 20131010.                                  

PCT Int. Appl. (2009), WO 2009042694 A1 20090402.                                 

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