CID 75480812

(1-methylcyclohexyl)methanesulfonyl chloride

Structural Information

Molecular Formula
C8H15ClO2S
SMILES
CC1(CCCCC1)CS(=O)(=O)Cl
InChI
InChI=1S/C8H15ClO2S/c1-8(7-12(9,10)11)5-3-2-4-6-8/h2-7H2,1H3
InChIKey
WIDKNGWZMIHFST-UHFFFAOYSA-N
Compound name
(1-methylcyclohexyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.04813 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.05541 144.1
[M+Na]+ 233.03735 154.5
[M+NH4]+ 228.08195 154.3
[M+K]+ 249.01129 144.9
[M-H]- 209.04085 144.9
[M+Na-2H]- 231.02280 150.1
[M]+ 210.04758 146.7
[M]- 210.04868 146.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.