CID 3062266

2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane, 4-(dimethoxymethyl)-, 1-oxide

Structural Information

Molecular Formula
C7H13O6P
SMILES
COC(C12COP(=O)(OC1)OC2)OC
InChI
InChI=1S/C7H13O6P/c1-9-6(10-2)7-3-11-14(8,12-4-7)13-5-7/h6H,3-5H2,1-2H3
InChIKey
NLNVOFMFAAVGAS-UHFFFAOYSA-N
Compound name
4-(dimethoxymethyl)-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane 1-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.04497 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.05225 147.3
[M+Na]+ 247.03419 155.5
[M+NH4]+ 242.07879 158.1
[M+K]+ 263.00813 148.9
[M-H]- 223.03769 146.9
[M+Na-2H]- 245.01964 144.9
[M]+ 224.04442 148.4
[M]- 224.04552 148.4
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.