CID 45574

63938-33-0

Structural Information

Molecular Formula

C₆H₁₂F₂O₂

SMILES

C(COCCF)OCCF

InChI

InChI=1S/C6H12F2O2/c7-1-3-9-5-6-10-4-2-8/h1-6H2

InChIKey

CQEZINWOTGMJQC-UHFFFAOYSA-N

Compound name

1,2-bis(2-fluoroethoxy)ethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 189
Patents: 154.08054 Da
Monoisotopic Mass: 0.6
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]+	155.08782	129.4
[M+Na]+	177.06976	136.6
[M-H]-	153.07326	126.8
[M+NH4]+	172.11436	150.5
[M+K]+	193.04370	136.6
[M+H-H2O]+	137.07780	122.8
[M+HCOO]-	199.07874	151.6
[M+CH3COO]-	213.09439	176.7
[M+Na-2H]-	175.05521	135.4
[M]+	154.07999	131.2
[M]-	154.08109	131.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe