CID 11658394

Diethyl (methoxymethyl)phosphonate

Structural Information

Molecular Formula
C6H15O4P
SMILES
CCOP(=O)(COC)OCC
InChI
InChI=1S/C6H15O4P/c1-4-9-11(7,6-8-3)10-5-2/h4-6H2,1-3H3
InChIKey
IWEOGHGFCXMKFM-UHFFFAOYSA-N
Compound name
1-[ethoxy(methoxymethyl)phosphoryl]oxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

185
Patents

182.0708 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.07808 140.6
[M+Na]+ 205.06002 148.0
[M-H]- 181.06352 139.8
[M+NH4]+ 200.10462 161.4
[M+K]+ 221.03396 149.3
[M+H-H2O]+ 165.06806 133.9
[M+HCOO]- 227.06900 169.2
[M+CH3COO]- 241.08465 181.6
[M+Na-2H]- 203.04547 145.0
[M]+ 182.07025 148.3
[M]- 182.07135 148.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe