CID 10926147

Perfluorohept-3-ene

Structural Information

Molecular Formula
C7F14
SMILES
C(=C(/C(C(F)(F)F)(F)F)\F)(\C(C(C(F)(F)F)(F)F)(F)F)/F
InChI
InChI=1S/C7F14/c8-1(2(9)4(12,13)6(16,17)18)3(10,11)5(14,15)7(19,20)21/b2-1+
InChIKey
UAEWLONMSWUOCA-OWOJBTEDSA-N
Compound name
(E)-1,1,1,2,2,3,4,5,5,6,6,7,7,7-tetradecafluorohept-3-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

432
Patents

349.97763 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.98491 171.8
[M+Na]+ 372.96685 171.9
[M+NH4]+ 368.01145 171.2
[M+K]+ 388.94079 171.1
[M-H]- 348.97035 168.2
[M+Na-2H]- 370.95230 170.7
[M]+ 349.97708 170.6
[M]- 349.97818 170.6
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