CID 2357660

4-amino-n-(3-chlorophenyl)benzene-1-sulfonamide

Structural Information

Molecular Formula

C₁₂H₁₁ClN₂O₂S

SMILES

C1=CC(=CC(=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C12H11ClN2O2S/c13-9-2-1-3-11(8-9)15-18(16,17)12-6-4-10(14)5-7-12/h1-8,15H,14H2

InChIKey

ZVOMLEQGMOLOEM-UHFFFAOYSA-N

Compound name

4-amino-N-(3-chlorophenyl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 11
Patents: 282.02298 Da
Monoisotopic Mass: 2.2
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]+	283.03026	158.9
[M+Na]+	305.01220	168.1
[M-H]-	281.01570	165.8
[M+NH4]+	300.05680	175.3
[M+K]+	320.98614	161.7
[M+H-H2O]+	265.02024	152.8
[M+HCOO]-	327.02118	174.8
[M+CH3COO]-	341.03683	198.0
[M+Na-2H]-	302.99765	163.9
[M]+	282.02243	160.9
[M]-	282.02353	160.9

Literature stripe

literature stripe

Patent stripe

patents stripe