CID 69629

Diethyl vinylphosphonate

Structural Information

Molecular Formula

C₆H₁₃O₃P

SMILES

CCOP(=O)(C=C)OCC

InChI

InChI=1S/C6H13O3P/c1-4-8-10(7,6-3)9-5-2/h6H,3-5H2,1-2H3

InChIKey

DREPONDJUKIQLX-UHFFFAOYSA-N

Compound name

1-[ethenyl(ethoxy)phosphoryl]oxyethane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 3156
Patents: 164.06023 Da
Monoisotopic Mass: 0.7
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]+	165.06751	136.3
[M+Na]+	187.04945	144.1
[M-H]-	163.05295	135.6
[M+NH4]+	182.09405	157.8
[M+K]+	203.02339	144.2
[M+H-H2O]+	147.05749	129.9
[M+HCOO]-	209.05843	164.8
[M+CH3COO]-	223.07408	178.6
[M+Na-2H]-	185.03490	140.6
[M]+	164.05968	141.9
[M]-	164.06078	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe