CID 155821064

2166947-04-0

Structural Information

Molecular Formula
C6H9ClF2O2S
SMILES
CC1(CC(C1)(F)F)CS(=O)(=O)Cl
InChI
InChI=1S/C6H9ClF2O2S/c1-5(4-12(7,10)11)2-6(8,9)3-5/h2-4H2,1H3
InChIKey
UAONRJNNVWEYSI-UHFFFAOYSA-N
Compound name
(3,3-difluoro-1-methylcyclobutyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.99799 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.00527 139.7
[M+Na]+ 240.98721 144.3
[M+NH4]+ 236.03181 145.2
[M+K]+ 256.96115 136.7
[M-H]- 216.99071 134.2
[M+Na-2H]- 238.97266 143.0
[M]+ 217.99744 138.4
[M]- 217.99854 138.4
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.