CID 5274090

Schembl9082319

Structural Information

Molecular Formula
C10H13FN2O3
SMILES
CC1=CN(C(=O)N=C1)[C@H]2C[C@@H]([C@H](O2)CO)F
InChI
InChI=1S/C10H13FN2O3/c1-6-3-12-10(15)13(4-6)9-2-7(11)8(5-14)16-9/h3-4,7-9,14H,2,5H2,1H3/t7-,8+,9+/m0/s1
InChIKey
RWYRMVKGAYHCPU-DJLDLDEBSA-N
Compound name
1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

228.09102 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.09830 146.8
[M+Na]+ 251.08024 156.5
[M-H]- 227.08374 149.5
[M+NH4]+ 246.12484 162.4
[M+K]+ 267.05418 154.4
[M+H-H2O]+ 211.08828 138.7
[M+HCOO]- 273.08922 165.1
[M+CH3COO]- 287.10487 186.2
[M+Na-2H]- 249.06569 149.2
[M]+ 228.09047 146.3
[M]- 228.09157 146.3
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.