CID 3076161

130366-46-0

Structural Information

Molecular Formula
C15H28N2O8P2
SMILES
CC1=CC(=O)N(C(=O)N1CCCP(=O)(OC)OC)CCCP(=O)(OC)OC
InChI
InChI=1S/C15H28N2O8P2/c1-13-12-14(18)17(9-7-11-27(21,24-4)25-5)15(19)16(13)8-6-10-26(20,22-2)23-3/h12H,6-11H2,1-5H3
InChIKey
PACHKEDACMOCOI-UHFFFAOYSA-N
Compound name
1,3-bis(3-dimethoxyphosphorylpropyl)-6-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

426.13208 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 427.13936 193.4
[M+Na]+ 449.12130 200.7
[M+NH4]+ 444.16590 205.3
[M+K]+ 465.09524 199.6
[M-H]- 425.12480 188.0
[M+Na-2H]- 447.10675 192.9
[M]+ 426.13153 192.2
[M]- 426.13263 192.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.