CID 14032

4100 hc

Structural Information

Molecular Formula

C₆H₁₆O₆P₂

SMILES

CCOP(OCC)OP(=O)(OC)OC

InChI

InChI=1S/C6H16O6P2/c1-5-10-13(11-6-2)12-14(7,8-3)9-4/h5-6H2,1-4H3

InChIKey

CNVLYZNEWMHIOR-UHFFFAOYSA-N

Compound name

diethoxyphosphanyl dimethyl phosphate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 246.0422 Da
Monoisotopic Mass: 0.2
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]+	247.04948	153.4
[M+Na]+	269.03142	159.8
[M+NH4]+	264.07602	157.5
[M+K]+	285.00536	158.1
[M-H]-	245.03492	148.8
[M+Na-2H]-	267.01687	153.2
[M]+	246.04165	152.4
[M]-	246.04275	152.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe