CID 2775011

156241-41-7

Structural Information

Molecular Formula
C4HF9O3S
SMILES
C(C(F)(F)F)(C(F)(F)F)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C4HF9O3S/c5-2(6,7)1(3(8,9)10)16-17(14,15)4(11,12)13/h1H
InChIKey
NRHQWNHARTXNOE-UHFFFAOYSA-N
Compound name
1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

299.95026 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.957536 144.9
[M+Na]+ 322.939478 154.4
[M-H]- 298.942984 134.7
[M+NH4]+ 317.984083 159.6
[M+K]+ 338.913418 152.4
[M+H-H2O]+ 282.947520 133.7
[M+HCOO]- 344.948461 148.5
[M+CH3COO]- 358.964111 195.9
[M+Na-2H]- 320.924926 147.4
[M]+ 299.94971142 135.2
[M]- 299.95080858 135.2
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

patents stripe