CID 84674725

3,3-difluoro-2,2-dimethylpropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H9ClF2O2S
SMILES
CC(C)(CS(=O)(=O)Cl)C(F)F
InChI
InChI=1S/C5H9ClF2O2S/c1-5(2,4(7)8)3-11(6,9)10/h4H,3H2,1-2H3
InChIKey
XZWPNUGBFGDLOG-UHFFFAOYSA-N
Compound name
3,3-difluoro-2,2-dimethylpropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.99799 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.00527 142.5
[M+Na]+ 228.98721 150.1
[M+NH4]+ 224.03181 148.3
[M+K]+ 244.96115 144.9
[M-H]- 204.99071 137.2
[M+Na-2H]- 226.97266 143.5
[M]+ 205.99744 142.5
[M]- 205.99854 142.5
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.