CID 5274140

Fluoro-[[(2s,5r)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxy]phosphinic acid

Structural Information

Molecular Formula
C10H12FN2O6P
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C=C[C@H](O2)COP(=O)(O)F
InChI
InChI=1S/C10H12FN2O6P/c1-6-4-13(10(15)12-9(6)14)8-3-2-7(19-8)5-18-20(11,16)17/h2-4,7-8H,5H2,1H3,(H,16,17)(H,12,14,15)/t7-,8+/m0/s1
InChIKey
ZIZQTVORFUXCRZ-JGVFFNPUSA-N
Compound name
fluoro-[[(2S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxy]phosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.0417 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.04898 161.8
[M+Na]+ 329.03092 171.0
[M-H]- 305.03442 162.5
[M+NH4]+ 324.07552 173.5
[M+K]+ 345.00486 169.5
[M+H-H2O]+ 289.03896 151.6
[M+HCOO]- 351.03990 184.1
[M+CH3COO]- 365.05555 196.2
[M+Na-2H]- 327.01637 162.5
[M]+ 306.04115 163.8
[M]- 306.04225 163.8
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.