CID 88987

Tetraethyl pyrophosphite

Structural Information

Molecular Formula

C₈H₂₀O₅P₂

SMILES

CCOP(OCC)OP(OCC)OCC

InChI

InChI=1S/C8H20O5P2/c1-5-9-14(10-6-2)13-15(11-7-3)12-8-4/h5-8H2,1-4H3

InChIKey

RDXABLXNTVBVML-UHFFFAOYSA-N

Compound name

diethoxyphosphanyl diethyl phosphite

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 798
Patents: 258.07858 Da
Monoisotopic Mass: 1.5
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]+	259.08586	164.5
[M+Na]+	281.06780	169.3
[M-H]-	257.07130	161.9
[M+NH4]+	276.11240	182.4
[M+K]+	297.04174	171.5
[M+H-H2O]+	241.07584	154.1
[M+HCOO]-	303.07678	197.0
[M+CH3COO]-	317.09243	199.2
[M+Na-2H]-	279.05325	161.5
[M]+	258.07803	175.9
[M]-	258.07913	175.9

Literature stripe

literature stripe

Patent stripe

patents stripe