CID 7873

Tepp

Structural Information

Molecular Formula

C₈H₂₀O₇P₂

SMILES

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

InChI

InChI=1S/C8H20O7P2/c1-5-11-16(9,12-6-2)15-17(10,13-7-3)14-8-4/h5-8H2,1-4H3

InChIKey

IDCBOTIENDVCBQ-UHFFFAOYSA-N

Compound name

diethoxyphosphoryl diethyl phosphate

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 87
References: 17361
Patents: 290.06842 Da
Monoisotopic Mass: 0.4
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]+	291.07570	162.8
[M+Na]+	313.05764	168.3
[M+NH4]+	308.10224	179.8
[M+K]+	329.03158	167.2
[M-H]-	289.06114	157.0
[M+Na-2H]-	311.04309	162.0
[M]+	290.06787	161.3
[M]-	290.06897	161.3

Literature stripe

literature stripe

Patent stripe

patents stripe