CID 137935802

2253640-63-8

Structural Information

Molecular Formula
C7H9ClF2O2S
SMILES
C1CC2C(C1)(C2(F)F)CS(=O)(=O)Cl
InChI
InChI=1S/C7H9ClF2O2S/c8-13(11,12)4-6-3-1-2-5(6)7(6,9)10/h5H,1-4H2
InChIKey
DVLFBRCWFGLOOO-UHFFFAOYSA-N
Compound name
(6,6-difluoro-1-bicyclo[3.1.0]hexanyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.99799 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.00527 136.0
[M+Na]+ 252.98721 147.9
[M-H]- 228.99071 139.0
[M+NH4]+ 248.03181 156.8
[M+K]+ 268.96115 144.3
[M+H-H2O]+ 212.99525 132.8
[M+HCOO]- 274.99619 145.5
[M+CH3COO]- 289.01184 185.7
[M+Na-2H]- 250.97266 141.6
[M]+ 229.99744 140.8
[M]- 229.99854 140.8
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.