CID 11700

597-40-0

Structural Information

Molecular Formula

C₅H₁₅NO₆P₂

SMILES

CN(C)P(=O)(OC)OP(=O)(OC)OC

InChI

InChI=1S/C5H15NO6P2/c1-6(2)13(7,9-3)12-14(8,10-4)11-5/h1-5H3

InChIKey

VOXPPLQBNKVMAC-UHFFFAOYSA-N

Compound name

[dimethylamino(methoxy)phosphoryl] dimethyl phosphate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 247.03746 Da
Monoisotopic Mass: -0.9
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]+	248.044736	151.1
[M+Na]+	270.026678	158.0
[M-H]-	246.030184	150.9
[M+NH4]+	265.071283	171.6
[M+K]+	286.000618	161.6
[M+H-H2O]+	230.034720	141.8
[M+HCOO]-	292.035661	186.0
[M+CH3COO]-	306.051311	198.0
[M+Na-2H]-	268.012126	155.1
[M]+	247.03691142	161.9
[M]-	247.03800858	161.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.