CID 2734764

4-bromo-2-chlorobenzenesulfonamide

Structural Information

Molecular Formula

C₆H₅BrClNO₂S

SMILES

C1=CC(=C(C=C1Br)Cl)S(=O)(=O)N

InChI

InChI=1S/C6H5BrClNO2S/c7-4-1-2-6(5(8)3-4)12(9,10)11/h1-3H,(H2,9,10,11)

InChIKey

BFZLQNCZBMUSRS-UHFFFAOYSA-N

Compound name

4-bromo-2-chlorobenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 69
Patents: 268.8913 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	269.89858	135.3
[M+Na]+	291.88052	138.6
[M+NH4]+	286.92512	140.2
[M+K]+	307.85446	138.1
[M-H]-	267.88402	135.5
[M+Na-2H]-	289.86597	138.9
[M]+	268.89075	135.3
[M]-	268.89185	135.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe