CID 2357265

2-amino-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid

Structural Information

Molecular Formula
C14H14N2O5S
SMILES
COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)N)C(=O)O
InChI
InChI=1S/C14H14N2O5S/c1-21-10-4-2-9(3-5-10)16-22(19,20)11-6-7-13(15)12(8-11)14(17)18/h2-8,16H,15H2,1H3,(H,17,18)
InChIKey
KDCLEXOJWZLARV-UHFFFAOYSA-N
Compound name
2-amino-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

322.06235 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.06963 170.1
[M+Na]+ 345.05157 179.9
[M+NH4]+ 340.09617 175.3
[M+K]+ 361.02551 174.6
[M-H]- 321.05507 172.0
[M+Na-2H]- 343.03702 175.8
[M]+ 322.06180 172.1
[M]- 322.06290 172.1
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

No patent data available for this compound.