CID 1502014

2-chloro-4-sulfamoylaniline

Structural Information

Molecular Formula

C₆H₇ClN₂O₂S

SMILES

C1=CC(=C(C=C1S(=O)(=O)N)Cl)N

InChI

InChI=1S/C6H7ClN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)

InChIKey

LFIOFZKZCDMGFG-UHFFFAOYSA-N

Compound name

4-amino-3-chlorobenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 60
References: 146
Patents: 205.99167 Da
Monoisotopic Mass: 0.8
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]+	206.99895	139.8
[M+Na]+	228.98089	150.7
[M+NH4]+	224.02549	147.6
[M+K]+	244.95483	144.2
[M-H]-	204.98439	141.4
[M+Na-2H]-	226.96634	145.1
[M]+	205.99112	142.3
[M]-	205.99222	142.3

Literature stripe

literature stripe

Patent stripe

patents stripe