CID 79862863

2,2-dimethylcyclopentane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO2S
SMILES
CC1(CCCC1S(=O)(=O)Cl)C
InChI
InChI=1S/C7H13ClO2S/c1-7(2)5-3-4-6(7)11(8,9)10/h6H,3-5H2,1-2H3
InChIKey
JBLMTRUVEYNVMR-UHFFFAOYSA-N
Compound name
2,2-dimethylcyclopentane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.03249 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03977 141.2
[M+Na]+ 219.02171 151.1
[M+NH4]+ 214.06631 151.3
[M+K]+ 234.99565 143.7
[M-H]- 195.02521 141.3
[M+Na-2H]- 217.00716 146.0
[M]+ 196.03194 143.4
[M]- 196.03304 143.4
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.