CID 2773719

Diethyl (n-methoxy-n-methylcarbamoylmethyl)phosphonate

Structural Information

Molecular Formula
C8H18NO5P
SMILES
CCOP(=O)(CC(=O)N(C)OC)OCC
InChI
InChI=1S/C8H18NO5P/c1-5-13-15(11,14-6-2)7-8(10)9(3)12-4/h5-7H2,1-4H3
InChIKey
WYLRYBDGIILFIR-UHFFFAOYSA-N
Compound name
2-diethoxyphosphoryl-N-methoxy-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

171
Patents

239.09225 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.09953 153.3
[M+Na]+ 262.08147 159.1
[M-H]- 238.08497 153.7
[M+NH4]+ 257.12607 171.9
[M+K]+ 278.05541 161.7
[M+H-H2O]+ 222.08951 145.5
[M+HCOO]- 284.09045 182.2
[M+CH3COO]- 298.10610 197.2
[M+Na-2H]- 260.06692 155.4
[M]+ 239.09170 162.2
[M]- 239.09280 162.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.