CID 14029

4100 bis hc

Structural Information

Molecular Formula
C6H16O6P2
SMILES
CCOP(=O)(OCC)OP(OC)OC
InChI
InChI=1S/C6H16O6P2/c1-5-10-14(7,11-6-2)12-13(8-3)9-4/h5-6H2,1-4H3
InChIKey
PUYLGTLIKPXPRP-UHFFFAOYSA-N
Compound name
dimethoxyphosphanyl diethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.0422 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.04948 153.4
[M+Na]+ 269.03142 159.8
[M+NH4]+ 264.07602 157.5
[M+K]+ 285.00536 158.1
[M-H]- 245.03492 148.8
[M+Na-2H]- 267.01687 153.2
[M]+ 246.04165 152.4
[M]- 246.04275 152.4
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.