CID 22279368

N-cyclopropylsulfamoyl chloride

Structural Information

Molecular Formula

C₃H₆ClNO₂S

SMILES

C1CC1NS(=O)(=O)Cl

InChI

InChI=1S/C3H6ClNO2S/c4-8(6,7)5-3-1-2-3/h3,5H,1-2H2

InChIKey

BFWHNTUPIABSEG-UHFFFAOYSA-N

Compound name

N-cyclopropylsulfamoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 149
Patents: 154.98077 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]+	155.988046	122.3
[M+Na]+	177.969988	132.6
[M-H]-	153.973494	127.3
[M+NH4]+	173.014593	139.4
[M+K]+	193.943928	128.9
[M+H-H2O]+	137.978030	117.9
[M+HCOO]-	199.978971	137.8
[M+CH3COO]-	213.994621	175.3
[M+Na-2H]-	175.955436	128.5
[M]+	154.98022142	127.3
[M]-	154.98131858	127.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe