CID 13361

Refchem:929181

Structural Information

Molecular Formula

SMILES

COP(=O)OC

InChI

InChI=1S/C2H7O3P/c1-4-6(3)5-2/h6H,1-2H3

InChIKey

HZCDANOFLILNSA-UHFFFAOYSA-N

Compound name

methoxyphosphonoyloxymethane

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 26
References: 0
Patents: 110.01328 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]+	111.02056	118.4
[M+Na]+	133.00250	126.9
[M-H]-	109.00600	118.2
[M+NH4]+	128.04710	142.0
[M+K]+	148.97644	128.8
[M+H-H2O]+	93.010540	112.2
[M+HCOO]-	155.01148	148.6
[M+CH3COO]-	169.02713	168.0
[M+Na-2H]-	130.98795	122.7
[M]+	110.01273	123.0
[M]-	110.01383	123.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.