CID 5274232

F-d4t-mep

Structural Information

Molecular Formula
C11H14FN2O6P
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C(=C[C@H](O2)COP(=O)(C)O)F
InChI
InChI=1S/C11H14FN2O6P/c1-6-4-14(11(16)13-9(6)15)10-8(12)3-7(20-10)5-19-21(2,17)18/h3-4,7,10H,5H2,1-2H3,(H,17,18)(H,13,15,16)/t7-,10+/m0/s1
InChIKey
GVKZAUYLQWCJJO-OIBJUYFYSA-N
Compound name
[(2S,5R)-4-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxy-methylphosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.05734 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.06462 166.4
[M+Na]+ 343.04656 176.1
[M-H]- 319.05006 167.3
[M+NH4]+ 338.09116 177.9
[M+K]+ 359.02050 174.4
[M+H-H2O]+ 303.05460 156.4
[M+HCOO]- 365.05554 188.3
[M+CH3COO]- 379.07119 200.6
[M+Na-2H]- 341.03201 166.0
[M]+ 320.05679 169.2
[M]- 320.05789 169.2
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.