CID 3724108

5-amino-2-chloro-n-(3-chloro-phenyl)-benzenesulfonamide

Structural Information

Molecular Formula
C12H10Cl2N2O2S
SMILES
C1=CC(=CC(=C1)Cl)NS(=O)(=O)C2=C(C=CC(=C2)N)Cl
InChI
InChI=1S/C12H10Cl2N2O2S/c13-8-2-1-3-10(6-8)16-19(17,18)12-7-9(15)4-5-11(12)14/h1-7,16H,15H2
InChIKey
NEACNGHHQWFDRG-UHFFFAOYSA-N
Compound name
5-amino-2-chloro-N-(3-chlorophenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

315.984 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.99128 165.2
[M+Na]+ 338.97322 175.4
[M-H]- 314.97672 171.8
[M+NH4]+ 334.01782 181.0
[M+K]+ 354.94716 168.1
[M+H-H2O]+ 298.98126 160.2
[M+HCOO]- 360.98220 176.0
[M+CH3COO]- 374.99785 203.6
[M+Na-2H]- 336.95867 168.7
[M]+ 315.98345 168.8
[M]- 315.98455 168.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.