CID 11789235

10438-96-7

Structural Information

Molecular Formula

SMILES

CNS(=O)(=O)Cl

InChI

InChI=1S/CH4ClNO2S/c1-3-6(2,4)5/h3H,1H3

InChIKey

UJJUEJRWNWVHCM-UHFFFAOYSA-N

Compound name

N-methylsulfamoyl chloride

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1456
Patents: 128.96513 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]+	129.972406	117.8
[M+Na]+	151.954348	127.6
[M-H]-	127.957854	119.2
[M+NH4]+	146.998953	140.9
[M+K]+	167.928288	125.3
[M+H-H2O]+	111.962390	114.9
[M+HCOO]-	173.963331	133.4
[M+CH3COO]-	187.978981	167.1
[M+Na-2H]-	149.939796	124.2
[M]+	128.96458142	120.9
[M]-	128.96567858	120.9

Literature stripe

literature stripe

Patent stripe

patents stripe