CID 578975

4-amino-n-(4-methoxyphenyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C13H14N2O3S
SMILES
COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C13H14N2O3S/c1-18-12-6-4-11(5-7-12)15-19(16,17)13-8-2-10(14)3-9-13/h2-9,15H,14H2,1H3
InChIKey
PKCILPHWDZXVQT-UHFFFAOYSA-N
Compound name
4-amino-N-(4-methoxyphenyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

32
Patents

278.0725 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.07978 159.8
[M+Na]+ 301.06172 167.6
[M-H]- 277.06522 166.4
[M+NH4]+ 296.10632 175.3
[M+K]+ 317.03566 163.2
[M+H-H2O]+ 261.06976 152.2
[M+HCOO]- 323.07070 180.0
[M+CH3COO]- 337.08635 199.5
[M+Na-2H]- 299.04717 164.9
[M]+ 278.07195 161.3
[M]- 278.07305 161.3
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