CID 162345601

8-1 olefin

Structural Information

Molecular Formula

C₉H₂F₁₆

SMILES

C=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F

InChI

InChI=1S/C9H2F16/c1-2(10)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)25/h1H2

InChIKey

WYSIIRZUWIQJCG-UHFFFAOYSA-N

Compound name

2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-hexadecafluoronon-1-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 413.9901 Da
Monoisotopic Mass: 5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	414.997376	176.6
[M+Na]+	436.979318	186.1
[M-H]-	412.982824	160.6
[M+NH4]+	432.023923	163.4
[M+K]+	452.953258	182.3
[M+H-H2O]+	396.987360	161.8
[M+HCOO]-	458.988301	174.5
[M+CH3COO]-	473.003951	225.2
[M+Na-2H]-	434.964766	177.8
[M]+	413.98955142	150.8
[M]-	413.99064858	150.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe