CID 14106996

Cyclopropylmethanesulfonyl chloride

Structural Information

Molecular Formula

C₄H₇ClO₂S

SMILES

C1CC1CS(=O)(=O)Cl

InChI

InChI=1S/C4H7ClO2S/c5-8(6,7)3-4-1-2-4/h4H,1-3H2

InChIKey

XJPMSKSCGIBWPC-UHFFFAOYSA-N

Compound name

cyclopropylmethanesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 398
Patents: 153.98553 Da
Monoisotopic Mass: 1.1
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]+	154.99281	131.4
[M+Na]+	176.97475	143.7
[M+NH4]+	172.01935	140.6
[M+K]+	192.94869	138.0
[M-H]-	152.97825	138.3
[M+Na-2H]-	174.96020	138.3
[M]+	153.98498	136.8
[M]-	153.98608	136.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe