CAS Registry Number 1172986-17-2
(Component: 916420-34-3)
Name:
2H-?1-?Benzothiopyran-?4-?amine, 6-?bromo-?3,?4-?dihydro-?, 1,?1-?dioxide, hydrochloride (1:1)

Chemical Formula: C9H11BrClNO2S
Exact Mass: 310.94
Molecular Weight: 312.61
m/z: 312.94 (100.0%), 310.94 (76.8%), 314.93 (28.4%), 313.94 (10.8%), 311.94 (8.5%), 312.93 (3.5%), 315.94 (2.8%), 316.93 (1.1%)

InChI:InChI=1S/C9H10BrNO2S.ClH/c10-6-1-2-9-7(5-6)8(11)3-4-14(9,12)13;/h1-2,5,8H,3-4,11H2;1H

InChI Key:WJWWQTOZSPMWQL-UHFFFAOYSA-N

Canonical SMILES:C1CS(=O)(=O)C2=C(C1N)C=C(C=C2)Br.Cl

Specification

98%

PCT Int. Appl. (2010), WO 2010137620 A1 20101202.