CID 9840

Bis(2-fluoroethyl) carbonate

Structural Information

Molecular Formula

C₅H₈F₂O₃

SMILES

C(CF)OC(=O)OCCF

InChI

InChI=1S/C5H8F2O3/c6-1-3-9-5(8)10-4-2-7/h1-4H2

InChIKey

YZWIIIGEQKTIMS-UHFFFAOYSA-N

Compound name

bis(2-fluoroethyl) carbonate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2398
Patents: 154.04414 Da
Monoisotopic Mass: 1.2
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]+	155.05142	126.8
[M+Na]+	177.03336	134.7
[M-H]-	153.03686	124.6
[M+NH4]+	172.07796	147.9
[M+K]+	193.00730	135.2
[M+H-H2O]+	137.04140	120.4
[M+HCOO]-	199.04234	148.8
[M+CH3COO]-	213.05799	174.2
[M+Na-2H]-	175.01881	132.1
[M]+	154.04359	128.2
[M]-	154.04469	128.2

Literature stripe

literature stripe

Patent stripe

patents stripe