CID 100972

Allyl 1,1,2,3,3,3-hexafluoropropyl ether

Structural Information

Molecular Formula
C6H6F6O
SMILES
C=CCOC(C(C(F)(F)F)F)(F)F
InChI
InChI=1S/C6H6F6O/c1-2-3-13-6(11,12)4(7)5(8,9)10/h2,4H,1,3H2
InChIKey
ADXLBHULARLUSE-UHFFFAOYSA-N
Compound name
1,1,1,2,3,3-hexafluoro-3-prop-2-enoxypropane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

126
Patents

208.03229 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.03957 162.3
[M+Na]+ 231.02151 165.8
[M+NH4]+ 226.06611 164.0
[M+K]+ 246.99545 162.2
[M-H]- 207.02501 153.8
[M+Na-2H]- 229.00696 160.7
[M]+ 208.03174 159.9
[M]- 208.03284 159.9
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