CID 12234445

2-chloropyridine-3-sulfonamide

Structural Information

Molecular Formula

C₅H₅ClN₂O₂S

SMILES

C1=CC(=C(N=C1)Cl)S(=O)(=O)N

InChI

InChI=1S/C5H5ClN2O2S/c6-5-4(11(7,9)10)2-1-3-8-5/h1-3H,(H2,7,9,10)

InChIKey

GUYJBKABCVQXFR-UHFFFAOYSA-N

Compound name

2-chloropyridine-3-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 111
Patents: 191.97603 Da
Monoisotopic Mass: 0.4
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]+	192.98331	135.6
[M+Na]+	214.96525	147.8
[M+NH4]+	210.00985	143.5
[M+K]+	230.93919	140.9
[M-H]-	190.96875	136.4
[M+Na-2H]-	212.95070	141.7
[M]+	191.97548	138.2
[M]-	191.97658	138.2

Literature stripe

literature stripe

Patent stripe

patents stripe