CID 120292

Hc 4032

Structural Information

Molecular Formula
C7H17NO7P2
SMILES
COP(=O)(N1CCOCC1)OP(=O)(OC)OC
InChI
InChI=1S/C7H17NO7P2/c1-11-16(9,8-4-6-14-7-5-8)15-17(10,12-2)13-3/h4-7H2,1-3H3
InChIKey
ZQGKSOCRWIWGPR-UHFFFAOYSA-N
Compound name
[methoxy(morpholin-4-yl)phosphoryl] dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.04803 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.05531 161.5
[M+Na]+ 312.03725 165.9
[M-H]- 288.04075 161.2
[M+NH4]+ 307.08185 174.8
[M+K]+ 328.01119 169.5
[M+H-H2O]+ 272.04529 150.4
[M+HCOO]- 334.04623 189.0
[M+CH3COO]- 348.06188 197.3
[M+Na-2H]- 310.02270 165.5
[M]+ 289.04748 167.6
[M]- 289.04858 167.6
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.