CID 3248918

17053-13-3

Structural Information

Molecular Formula
C8H19O5P
SMILES
CCOP(=O)(CC(OC)OC)OCC
InChI
InChI=1S/C8H19O5P/c1-5-12-14(9,13-6-2)7-8(10-3)11-4/h8H,5-7H2,1-4H3
InChIKey
XMORGWRBGODJMM-UHFFFAOYSA-N
Compound name
2-diethoxyphosphoryl-1,1-dimethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

226.09702 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10430 152.4
[M+Na]+ 249.08624 158.7
[M-H]- 225.08974 151.4
[M+NH4]+ 244.13084 171.3
[M+K]+ 265.06018 160.4
[M+H-H2O]+ 209.09428 145.2
[M+HCOO]- 271.09522 179.6
[M+CH3COO]- 285.11087 190.5
[M+Na-2H]- 247.07169 154.8
[M]+ 226.09647 161.7
[M]- 226.09757 161.7
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

patents stripe