CID 14031

4101 bis hc

Structural Information

Molecular Formula
C4H12O6P2
SMILES
COP(OC)OP(=O)(OC)OC
InChI
InChI=1S/C4H12O6P2/c1-6-11(7-2)10-12(5,8-3)9-4/h1-4H3
InChIKey
GZUJNAIOINJUIH-UHFFFAOYSA-N
Compound name
dimethoxyphosphanyl dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

218.01091 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.018186 145.4
[M+Na]+ 241.000128 152.7
[M-H]- 217.003634 143.8
[M+NH4]+ 236.044733 165.0
[M+K]+ 256.974068 155.8
[M+H-H2O]+ 201.008170 136.3
[M+HCOO]- 263.009111 179.1
[M+CH3COO]- 277.024761 188.0
[M+Na-2H]- 238.985576 147.5
[M]+ 218.01036142 156.1
[M]- 218.01145858 156.1
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