CID 71429346

1,1,1,2,2,3,3,4-octafluorodec-4-ene

Structural Information

Molecular Formula
C10H12F8
SMILES
CCCCCC=C(C(C(C(F)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C10H12F8/c1-2-3-4-5-6-7(11)8(12,13)9(14,15)10(16,17)18/h6H,2-5H2,1H3
InChIKey
BWRNLAVMSIJMQH-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4-octafluorodec-4-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

284.08112 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.08840 156.5
[M+Na]+ 307.07034 163.9
[M-H]- 283.07384 146.5
[M+NH4]+ 302.11494 171.9
[M+K]+ 323.04428 160.5
[M+H-H2O]+ 267.07838 145.8
[M+HCOO]- 329.07932 164.9
[M+CH3COO]- 343.09497 202.1
[M+Na-2H]- 305.05579 157.6
[M]+ 284.08057 145.3
[M]- 284.08167 145.3
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.