CID 54240412

67103-04-2

Structural Information

Molecular Formula
C11H5F17
SMILES
CC=CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H5F17/c1-2-3-4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)28/h2-3H,1H3
InChIKey
QPPMZWQUDCDFTM-UHFFFAOYSA-N
Compound name
4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundec-2-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

9
Patents

460.012 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 461.01928 163.2
[M+Na]+ 483.00122 169.8
[M-H]- 459.00472 168.4
[M+NH4]+ 478.04582 171.5
[M+K]+ 498.97516 177.4
[M+H-H2O]+ 443.00926 175.8
[M+HCOO]- 505.01020 184.5
[M+CH3COO]- 519.02585 232.3
[M+Na-2H]- 480.98667 163.2
[M]+ 460.01145 162.4
[M]- 460.01255 162.4
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