CID 221849

N-(4-acetylphenyl)-4-aminobenzenesulfonamide

Structural Information

Molecular Formula
C14H14N2O3S
SMILES
CC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C14H14N2O3S/c1-10(17)11-2-6-13(7-3-11)16-20(18,19)14-8-4-12(15)5-9-14/h2-9,16H,15H2,1H3
InChIKey
KLQGVVDBXSZWDN-UHFFFAOYSA-N
Compound name
N-(4-acetylphenyl)-4-aminobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

25
Patents

290.0725 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.07978 163.6
[M+Na]+ 313.06172 170.9
[M-H]- 289.06522 170.1
[M+NH4]+ 308.10632 178.4
[M+K]+ 329.03566 166.3
[M+H-H2O]+ 273.06976 156.0
[M+HCOO]- 335.07070 182.6
[M+CH3COO]- 349.08635 202.6
[M+Na-2H]- 311.04717 167.2
[M]+ 290.07195 164.1
[M]- 290.07305 164.1
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