CID 23075930

1,3-thiazole-5-sulfonamide

Structural Information

Molecular Formula

C₃H₄N₂O₂S₂

SMILES

C1=C(SC=N1)S(=O)(=O)N

InChI

InChI=1S/C3H4N2O2S2/c4-9(6,7)3-1-5-2-8-3/h1-2H,(H2,4,6,7)

InChIKey

OTBFUMSMIVYLAK-UHFFFAOYSA-N

Compound name

1,3-thiazole-5-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 308
Patents: 163.97142 Da
Monoisotopic Mass: -0.1
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]+	164.97870	131.6
[M+Na]+	186.96064	140.2
[M+NH4]+	182.00524	139.4
[M+K]+	202.93458	134.6
[M-H]-	162.96414	131.6
[M+Na-2H]-	184.94609	135.0
[M]+	163.97087	133.4
[M]-	163.97197	133.4

Literature stripe

literature stripe

Patent stripe

patents stripe