CID 720082

N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]acetamide

Structural Information

Molecular Formula
C14H13ClN2O3S
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H13ClN2O3S/c1-10(18)16-12-6-8-14(9-7-12)21(19,20)17-13-4-2-11(15)3-5-13/h2-9,17H,1H3,(H,16,18)
InChIKey
MJIHMTDNBRWRDM-UHFFFAOYSA-N
Compound name
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1
Patents

324.03354 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.04082 169.7
[M+Na]+ 347.02276 177.8
[M-H]- 323.02626 176.9
[M+NH4]+ 342.06736 184.5
[M+K]+ 362.99670 172.0
[M+H-H2O]+ 307.03080 163.2
[M+HCOO]- 369.03174 185.0
[M+CH3COO]- 383.04739 206.1
[M+Na-2H]- 345.00821 174.0
[M]+ 324.03299 173.5
[M]- 324.03409 173.5
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