CID 45075664

67490-36-2

Structural Information

Molecular Formula
C4HF9O
SMILES
C(C(C(OC(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C4HF9O/c5-1(6)2(7,8)3(9,10)14-4(11,12)13/h1H
InChIKey
GGGJFCBJUNVNMG-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3-hexafluoro-1-(trifluoromethoxy)propane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

11
Patents

235.98837 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.99565 176.4
[M+Na]+ 258.97759 177.6
[M+NH4]+ 254.02219 176.2
[M+K]+ 274.95153 175.0
[M-H]- 234.98109 168.4
[M+Na-2H]- 256.96304 173.8
[M]+ 235.98782 173.9
[M]- 235.98892 173.9
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