CID 310128

4-chloro-2'-methoxybenzenesulfonanilide

Structural Information

Molecular Formula
C13H12ClNO3S
SMILES
COC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C13H12ClNO3S/c1-18-13-5-3-2-4-12(13)15-19(16,17)11-8-6-10(14)7-9-11/h2-9,15H,1H3
InChIKey
HSLJICOYFKROTA-UHFFFAOYSA-N
Compound name
4-chloro-N-(2-methoxyphenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

7
Patents

297.02264 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.02992 162.1
[M+Na]+ 320.01186 171.6
[M-H]- 296.01536 169.5
[M+NH4]+ 315.05646 178.5
[M+K]+ 335.98580 166.1
[M+H-H2O]+ 280.01990 155.9
[M+HCOO]- 342.02084 177.5
[M+CH3COO]- 356.03649 198.6
[M+Na-2H]- 317.99731 167.2
[M]+ 297.02209 167.5
[M]- 297.02319 167.5
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

patents stripe