CID 3084818

41197-29-9

Structural Information

Molecular Formula

SMILES

C(S(=O)(=O)Cl)(Cl)Cl

InChI

InChI=1S/CHCl3O2S/c2-1(3)7(4,5)6/h1H

InChIKey

ZTCPYHGKJGSSPD-UHFFFAOYSA-N

Compound name

dichloromethanesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 159
Patents: 181.87628 Da
Monoisotopic Mass: 1.8
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]+	182.88356	123.8
[M+Na]+	204.86550	134.0
[M-H]-	180.86900	124.2
[M+NH4]+	199.91010	145.2
[M+K]+	220.83944	130.1
[M+H-H2O]+	164.87354	123.2
[M+HCOO]-	226.87448	127.2
[M+CH3COO]-	240.89013	174.3
[M+Na-2H]-	202.85095	127.3
[M]+	181.87573	127.5
[M]-	181.87683	127.5

Literature stripe

literature stripe

Patent stripe

patents stripe