CID 3792475

2,2,3,3-tetrafluoropropyl trifluoromethanesulfonate

Structural Information

Molecular Formula
C4H3F7O3S
SMILES
C(C(C(F)F)(F)F)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C4H3F7O3S/c5-2(6)3(7,8)1-14-15(12,13)4(9,10)11/h2H,1H2
InChIKey
OSWSZHMBICDPQH-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoropropyl trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

394
Patents

263.96912 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.97640 139.8
[M+Na]+ 286.95834 148.8
[M-H]- 262.96184 131.6
[M+NH4]+ 282.00294 156.1
[M+K]+ 302.93228 147.0
[M+H-H2O]+ 246.96638 129.8
[M+HCOO]- 308.96732 146.8
[M+CH3COO]- 322.98297 190.6
[M+Na-2H]- 284.94379 142.1
[M]+ 263.96857 133.8
[M]- 263.96967 133.8
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

patents stripe