CID 3013879

Vinyl perfluorovalerate

Structural Information

Molecular Formula

C₇H₃F₉O₂

SMILES

C=COC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C7H3F9O2/c1-2-18-3(17)4(8,9)5(10,11)6(12,13)7(14,15)16/h2H,1H2

InChIKey

ABKMQSRPKFUWEH-UHFFFAOYSA-N

Compound name

ethenyl 2,2,3,3,4,4,5,5,5-nonafluoropentanoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2
Patents: 289.99893 Da
Monoisotopic Mass: 3.7
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]+	291.006206	148.9
[M+Na]+	312.988148	158.2
[M-H]-	288.991654	138.6
[M+NH4]+	308.032753	163.8
[M+K]+	328.962088	156.0
[M+H-H2O]+	272.996190	138.3
[M+HCOO]-	334.997131	156.4
[M+CH3COO]-	349.012781	199.6
[M+Na-2H]-	310.973596	152.5
[M]+	289.99838142	136.6
[M]-	289.99947858	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe