CID 71331143

1,1,1,2,3,3-hexafluoro-2,3-bis(trifluoromethoxy)propane

Structural Information

Molecular Formula
C5F12O2
SMILES
C(C(OC(F)(F)F)(F)F)(C(F)(F)F)(OC(F)(F)F)F
InChI
InChI=1S/C5F12O2/c6-1(2(7,8)9,18-4(12,13)14)3(10,11)19-5(15,16)17
InChIKey
RVFUYJVYFFEUCR-UHFFFAOYSA-N
Compound name
1,1,1,2,3,3-hexafluoro-2,3-bis(trifluoromethoxy)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.97067 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.97795 180.2
[M+Na]+ 342.95989 180.4
[M+NH4]+ 338.00449 179.3
[M+K]+ 358.93383 178.8
[M-H]- 318.96339 174.6
[M+Na-2H]- 340.94534 178.0
[M]+ 319.97012 178.5
[M]- 319.97122 178.5
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.