CID 134472

N,n-dimethylsulfamide

Structural Information

Molecular Formula

C₂H₈N₂O₂S

SMILES

CN(C)S(=O)(=O)N

InChI

InChI=1S/C2H8N2O2S/c1-4(2)7(3,5)6/h1-2H3,(H2,3,5,6)

InChIKey

QMHAHUAQAJVBIW-UHFFFAOYSA-N

Compound name

[methyl(sulfamoyl)amino]methane

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 4
References: 7427
Patents: 124.03065 Da
Monoisotopic Mass: -1.2
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]+	125.037926	120.5
[M+Na]+	147.019868	128.5
[M-H]-	123.023374	122.4
[M+NH4]+	142.064473	142.9
[M+K]+	162.993808	128.8
[M+H-H2O]+	107.027910	115.5
[M+HCOO]-	169.028851	140.9
[M+CH3COO]-	183.044501	173.9
[M+Na-2H]-	145.005316	125.4
[M]+	124.03010142	121.7
[M]-	124.03119858	121.7

Literature stripe

literature stripe

Patent stripe

patents stripe