CID 122163963

1955557-19-3

Structural Information

Molecular Formula
C6H9ClF2O2S
SMILES
CC1(C(C1(F)F)CS(=O)(=O)Cl)C
InChI
InChI=1S/C6H9ClF2O2S/c1-5(2)4(6(5,8)9)3-12(7,10)11/h4H,3H2,1-2H3
InChIKey
OEKZGHHCXOPBIY-UHFFFAOYSA-N
Compound name
(2,2-difluoro-3,3-dimethylcyclopropyl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.99799 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.00527 127.8
[M+Na]+ 240.98721 140.0
[M-H]- 216.99071 130.8
[M+NH4]+ 236.03181 146.7
[M+K]+ 256.96115 137.1
[M+H-H2O]+ 200.99525 124.6
[M+HCOO]- 262.99619 138.6
[M+CH3COO]- 277.01184 186.1
[M+Na-2H]- 238.97266 133.5
[M]+ 217.99744 134.1
[M]- 217.99854 134.1
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.