CID 72879

Methanesulfonamide

Structural Information

Molecular Formula

SMILES

CS(=O)(=O)N

InChI

InChI=1S/CH5NO2S/c1-5(2,3)4/h1H3,(H2,2,3,4)

InChIKey

HNQIVZYLYMDVSB-UHFFFAOYSA-N

Compound name

methanesulfonamide

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 75
References: 85197
Patents: 95.0041 Da
Monoisotopic Mass: -1.1
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]+	96.011376	112.5
[M+Na]+	117.993318	121.7
[M-H]-	93.996824	113.3
[M+NH4]+	113.037923	135.9
[M+K]+	133.967258	121.0
[M+H-H2O]+	78.001360	108.5
[M+HCOO]-	140.002301	131.9
[M+CH3COO]-	154.017951	162.4
[M+Na-2H]-	115.978766	118.2
[M]+	95.00355142	113.0
[M]-	95.00464858	113.0

Literature stripe

literature stripe

Patent stripe

patents stripe