CID 462434

5-hydroxysulfadiazine

Structural Information

Molecular Formula
C10H10N4O3S
SMILES
C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=C(C=N2)O
InChI
InChI=1S/C10H10N4O3S/c11-7-1-3-9(4-2-7)18(16,17)14-10-12-5-8(15)6-13-10/h1-6,15H,11H2,(H,12,13,14)
InChIKey
VBMYFGQAZZYDIY-UHFFFAOYSA-N
Compound name
4-amino-N-(5-hydroxypyrimidin-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

266.04736 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05464 155.4
[M+Na]+ 289.03658 164.2
[M-H]- 265.04008 158.5
[M+NH4]+ 284.08118 168.0
[M+K]+ 305.01052 159.0
[M+H-H2O]+ 249.04462 147.3
[M+HCOO]- 311.04556 172.6
[M+CH3COO]- 325.06121 193.7
[M+Na-2H]- 287.02203 161.8
[M]+ 266.04681 154.9
[M]- 266.04791 154.9
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.