CID 69880

773-17-1

Structural Information

Molecular Formula

C₅H₂F₈

SMILES

C1(C(C(C(C1(F)F)(F)F)F)(F)F)F

InChI

InChI=1S/C5H2F8/c6-1-3(8,9)2(7)5(12,13)4(1,10)11/h1-2H

InChIKey

WAECBMNQMWVHQC-UHFFFAOYSA-N

Compound name

1,1,2,2,3,4,4,5-octafluorocyclopentane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 214.00287 Da
Monoisotopic Mass: 2.8
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]+	215.010146	122.8
[M+Na]+	236.992088	136.5
[M-H]-	212.995594	118.2
[M+NH4]+	232.036693	149.3
[M+K]+	252.966028	133.5
[M+H-H2O]+	197.000130	115.1
[M+HCOO]-	259.001071	138.0
[M+CH3COO]-	273.016721	187.4
[M+Na-2H]-	234.977536	126.0
[M]+	214.00232142	111.8
[M]-	214.00341858	111.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe