CID 148510

50930-57-9

Structural Information

Molecular Formula

C₁₁H₁₁N₃O₃S

SMILES

C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=C(C=C2)O

InChI

InChI=1S/C11H11N3O3S/c12-8-1-4-10(5-2-8)18(16,17)14-11-6-3-9(15)7-13-11/h1-7,15H,12H2,(H,13,14)

InChIKey

XMCHHHBDBWYWSU-UHFFFAOYSA-N

Compound name

4-amino-N-(5-hydroxy-2-pyridinyl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 265.05212 Da
Monoisotopic Mass: 1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	266.059396	155.2
[M+Na]+	288.041338	163.5
[M-H]-	264.044844	159.5
[M+NH4]+	283.085943	169.2
[M+K]+	304.015278	158.4
[M+H-H2O]+	248.049380	147.6
[M+HCOO]-	310.050321	173.4
[M+CH3COO]-	324.065971	193.9
[M+Na-2H]-	286.026786	161.1
[M]+	265.05157142	154.7
[M]-	265.05266858	154.7

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.