CID 12643061

1-chloro-1,2,2,2-tetrafluoroethanesulfonyl fluoride

Structural Information

Molecular Formula
C2ClF5O2S
SMILES
C(C(F)(S(=O)(=O)F)Cl)(F)(F)F
InChI
InChI=1S/C2ClF5O2S/c3-1(4,2(5,6)7)11(8,9)10
InChIKey
GWIPXKUCVLSQMA-UHFFFAOYSA-N
Compound name
1-chloro-1,2,2,2-tetrafluoroethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

217.92278 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.930056 126.6
[M+Na]+ 240.911998 137.5
[M-H]- 216.915504 121.7
[M+NH4]+ 235.956603 146.2
[M+K]+ 256.885938 134.2
[M+H-H2O]+ 200.920040 120.0
[M+HCOO]- 262.920981 132.9
[M+CH3COO]- 276.936631 179.8
[M+Na-2H]- 238.897446 131.6
[M]+ 217.92223142 123.7
[M]- 217.92332858 123.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.