CAS Registry Number: 14668-29-2

Name:

Propanenitrile, 2-​methyl-​2-​(methylsulfonyl)​-
Propionitrile, 2-​methyl-​2-​(methylsulfonyl)​- (8CI); 2-​Methyl-​2-​(methylsulfonyl)​propanenitrile; 2-​Methyl-​2-​(methylsulfonyl)​propionitrile 

Chemical Formula: C5H9NO2S
Exact Mass: 147.04
Molecular Weight: 147.20
m/z: 147.04 (100.0%), 148.04 (5.6%), 149.03 (4.5%), 148.03 (1.2%)

InChI: InChI=1S/C5H9NO2S/c1-5(2,4-6)9(3,7)8/h1-3H3
InChIKey: MPXOEOMIERYCLI-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C#N)S(=O)(=O)C

Specification

98%

PCT Int. Appl. (2014), WO 2014059185 A1 20140417.

PCT Int. Appl. (2014), WO 2014099794 A1 20140626.