CID 2758305

1478-53-1

Structural Information

Molecular Formula

C₅H₁₁F₂O₃P

SMILES

CCOP(=O)(C(F)F)OCC

InChI

InChI=1S/C5H11F2O3P/c1-3-9-11(8,5(6)7)10-4-2/h5H,3-4H2,1-2H3

InChIKey

VVFGLBKYBBUTRO-UHFFFAOYSA-N

Compound name

1-[difluoromethyl(ethoxy)phosphoryl]oxyethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 583
Patents: 188.04138 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]+	189.04866	138.5
[M+Na]+	211.03060	146.2
[M-H]-	187.03410	135.2
[M+NH4]+	206.07520	158.8
[M+K]+	227.00454	146.8
[M+H-H2O]+	171.03864	130.2
[M+HCOO]-	233.03958	164.0
[M+CH3COO]-	247.05523	182.8
[M+Na-2H]-	209.01605	140.8
[M]+	188.04083	141.2
[M]-	188.04193	141.2

Literature stripe

literature stripe

Patent stripe

patents stripe