CID 22098552

(2-chloroethyl)sulfamoyl chloride

Structural Information

Molecular Formula

C₂H₅Cl₂NO₂S

SMILES

C(CCl)NS(=O)(=O)Cl

InChI

InChI=1S/C2H5Cl2NO2S/c3-1-2-5-8(4,6)7/h5H,1-2H2

InChIKey

YKEZOKIPIIBNDN-UHFFFAOYSA-N

Compound name

N-(2-chloroethyl)sulfamoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 87
Patents: 176.9418 Da
Monoisotopic Mass: 0.7
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]+	177.94908	128.1
[M+Na]+	199.93102	137.6
[M-H]-	175.93452	128.9
[M+NH4]+	194.97562	149.7
[M+K]+	215.90496	133.7
[M+H-H2O]+	159.93906	126.0
[M+HCOO]-	221.94000	138.4
[M+CH3COO]-	235.95565	175.1
[M+Na-2H]-	197.91647	133.3
[M]+	176.94125	132.3
[M]-	176.94235	132.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe