CID 2775068

(e)-perfluoro-4-methylpent-2-enoyl fluoride

Structural Information

Molecular Formula

C₆F₁₀O

SMILES

C(=C(/C(C(F)(F)F)(C(F)(F)F)F)\F)(\C(=O)F)/F

InChI

InChI=1S/C6F10O/c7-1(3(9)17)2(8)4(10,5(11,12)13)6(14,15)16/b2-1+

InChIKey

ZDDYAQBRMKIGMY-OWOJBTEDSA-N

Compound name

(E)-2,3,4,5,5,5-hexafluoro-4-(trifluoromethyl)pent-2-enoyl fluoride

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 277.97894 Da
Monoisotopic Mass: 3.1
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]+	278.986216	143.1
[M+Na]+	300.968158	152.2
[M-H]-	276.971664	131.7
[M+NH4]+	296.012763	158.3
[M+K]+	316.942098	149.8
[M+H-H2O]+	260.976200	131.6
[M+HCOO]-	322.977141	149.4
[M+CH3COO]-	336.992791	198.2
[M+Na-2H]-	298.953606	143.3
[M]+	277.97839142	127.1
[M]-	277.97948858	127.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.