CID 170456253

4-amino-2,3-dihydroxybenzenesulfonamide

Structural Information

Molecular Formula
C6H8N2O4S
SMILES
C1=CC(=C(C(=C1N)O)O)S(=O)(=O)N
InChI
InChI=1S/C6H8N2O4S/c7-3-1-2-4(13(8,11)12)6(10)5(3)9/h1-2,9-10H,7H2,(H2,8,11,12)
InChIKey
YQFBUMHHBFZHLT-UHFFFAOYSA-N
Compound name
4-amino-2,3-dihydroxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.02048 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.027756 138.0
[M+Na]+ 227.009698 147.0
[M-H]- 203.013204 139.0
[M+NH4]+ 222.054303 155.2
[M+K]+ 242.983638 143.1
[M+H-H2O]+ 187.017740 132.7
[M+HCOO]- 249.018681 155.2
[M+CH3COO]- 263.034331 181.0
[M+Na-2H]- 224.995146 141.1
[M]+ 204.01993142 136.4
[M]- 204.02102858 136.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.