CID 4131038

162246-77-7

Structural Information

Molecular Formula

C₁₀H₁₉O₇P

SMILES

CCOC(=O)C(OC(=O)C)P(=O)(OCC)OCC

InChI

InChI=1S/C10H19O7P/c1-5-14-9(12)10(17-8(4)11)18(13,15-6-2)16-7-3/h10H,5-7H2,1-4H3

InChIKey

QHQNXSICNKWLOC-UHFFFAOYSA-N

Compound name

ethyl 2-acetyloxy-2-diethoxyphosphorylacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 125
Patents: 282.08685 Da
Monoisotopic Mass: 0.5
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]+	283.09413	161.3
[M+Na]+	305.07607	166.8
[M+NH4]+	300.12067	180.2
[M+K]+	321.05001	166.2
[M-H]-	281.07957	155.6
[M+Na-2H]-	303.06152	159.9
[M]+	282.08630	159.7
[M]-	282.08740	159.7

Literature stripe

literature stripe

Patent stripe

patents stripe