CID 468895

2-amino-n-(4-sulfamoylphenyl)benzamide

Structural Information

Molecular Formula
C13H13N3O3S
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)N
InChI
InChI=1S/C13H13N3O3S/c14-12-4-2-1-3-11(12)13(17)16-9-5-7-10(8-6-9)20(15,18)19/h1-8H,14H2,(H,16,17)(H2,15,18,19)
InChIKey
PJKOYUJBAVKORH-UHFFFAOYSA-N
Compound name
2-amino-N-(4-sulfamoylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

291.06775 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.075026 162.8
[M+Na]+ 314.056968 169.7
[M-H]- 290.060474 168.9
[M+NH4]+ 309.101573 177.0
[M+K]+ 330.030908 164.9
[M+H-H2O]+ 274.065010 155.0
[M+HCOO]- 336.065951 182.5
[M+CH3COO]- 350.081601 203.8
[M+Na-2H]- 312.042416 166.6
[M]+ 291.06720142 161.2
[M]- 291.06829858 161.2
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.