CID 14310981

8,9,10,11-tetrafluoro-8e,10e-dodecadien-1-ol

Structural Information

Molecular Formula
C12H18F4O
SMILES
C/C(=C(/C(=C(/CCCCCCCO)\F)/F)\F)/F
InChI
InChI=1S/C12H18F4O/c1-9(13)11(15)12(16)10(14)7-5-3-2-4-6-8-17/h17H,2-8H2,1H3/b11-9+,12-10+
InChIKey
QECZLRUNAWQRHS-WGDLNXRISA-N
Compound name
(8E,10E)-8,9,10,11-tetrafluorododeca-8,10-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

254.12938 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13666 158.8
[M+Na]+ 277.11860 163.1
[M-H]- 253.12210 151.4
[M+NH4]+ 272.16320 174.7
[M+K]+ 293.09254 159.8
[M+H-H2O]+ 237.12664 150.0
[M+HCOO]- 299.12758 171.5
[M+CH3COO]- 313.14323 195.9
[M+Na-2H]- 275.10405 154.7
[M]+ 254.12883 152.7
[M]- 254.12993 152.7
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