CID 54594730

N,n-dimethyl-1h-pyrazole-4-sulfonamide

Structural Information

Molecular Formula

C₅H₉N₃O₂S

SMILES

CN(C)S(=O)(=O)C1=CNN=C1

InChI

InChI=1S/C5H9N3O2S/c1-8(2)11(9,10)5-3-6-7-4-5/h3-4H,1-2H3,(H,6,7)

InChIKey

HEIPZBCMZXCIPT-UHFFFAOYSA-N

Compound name

N,N-dimethyl-1H-pyrazole-4-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 175.04155 Da
Monoisotopic Mass: -0.6
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]+	176.04883	135.7
[M+Na]+	198.03077	144.4
[M+NH4]+	193.07537	142.2
[M+K]+	214.00471	141.2
[M-H]-	174.03427	134.6
[M+Na-2H]-	196.01622	139.6
[M]+	175.04100	136.7
[M]-	175.04210	136.7

Literature stripe

literature stripe

Patent stripe

patents stripe