CID 137951954

(1,3-dimethylcyclobutyl)methanesulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO2S
SMILES
CC1CC(C1)(C)CS(=O)(=O)Cl
InChI
InChI=1S/C7H13ClO2S/c1-6-3-7(2,4-6)5-11(8,9)10/h6H,3-5H2,1-2H3
InChIKey
ZMMOCQAYFMRDKX-UHFFFAOYSA-N
Compound name
(1,3-dimethylcyclobutyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.03249 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03977 134.4
[M+Na]+ 219.02171 140.7
[M+NH4]+ 214.06631 140.3
[M+K]+ 234.99565 134.2
[M-H]- 195.02521 131.9
[M+Na-2H]- 217.00716 137.7
[M]+ 196.03194 134.3
[M]- 196.03304 134.3
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.