CID 83671419

1507845-05-7

Structural Information

Molecular Formula
C10H19ClO2S
SMILES
CC1(CCC(CC1)CCS(=O)(=O)Cl)C
InChI
InChI=1S/C10H19ClO2S/c1-10(2)6-3-9(4-7-10)5-8-14(11,12)13/h9H,3-8H2,1-2H3
InChIKey
OSPHLFYRZOPBKC-UHFFFAOYSA-N
Compound name
2-(4,4-dimethylcyclohexyl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.07942 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.086696 149.3
[M+Na]+ 261.068638 156.4
[M-H]- 237.072144 152.6
[M+NH4]+ 256.113243 170.5
[M+K]+ 277.042578 152.7
[M+H-H2O]+ 221.076680 146.1
[M+HCOO]- 283.077621 158.7
[M+CH3COO]- 297.093271 186.5
[M+Na-2H]- 259.054086 152.1
[M]+ 238.07887142 151.1
[M]- 238.07996858 151.1
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.