CID 452269

129151-66-2

Structural Information

Molecular Formula
C10H15N2O7P
SMILES
C1C[C@@H](O[C@@H]1COCP(=O)(O)O)N2C=CC(=O)NC2=O
InChI
InChI=1S/C10H15N2O7P/c13-8-3-4-12(10(14)11-8)9-2-1-7(19-9)5-18-6-20(15,16)17/h3-4,7,9H,1-2,5-6H2,(H,11,13,14)(H2,15,16,17)/t7-,9+/m0/s1
InChIKey
GLMGVORAWLDEJT-IONNQARKSA-N
Compound name
[(2S,5R)-5-(2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxymethylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

306.06168 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.06896 163.2
[M+Na]+ 329.05090 169.7
[M-H]- 305.05440 163.0
[M+NH4]+ 324.09550 173.7
[M+K]+ 345.02484 168.6
[M+H-H2O]+ 289.05894 153.7
[M+HCOO]- 351.05988 183.7
[M+CH3COO]- 365.07553 192.8
[M+Na-2H]- 327.03635 164.1
[M]+ 306.06113 164.0
[M]- 306.06223 164.0
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.