CID 16072581

N-3-(methyl)-flt

Structural Information

Molecular Formula
C11H15FN2O4
SMILES
CC1=CN(C(=O)N(C1=O)C)[C@H]2C[C@@H]([C@H](O2)CO)F
InChI
InChI=1S/C11H15FN2O4/c1-6-4-14(11(17)13(2)10(6)16)9-3-7(12)8(5-15)18-9/h4,7-9,15H,3,5H2,1-2H3/t7-,8+,9+/m0/s1
InChIKey
FOMAIUYMWHTMEU-DJLDLDEBSA-N
Compound name
1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]-3,5-dimethylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

258.1016 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.10888 153.1
[M+Na]+ 281.09082 164.3
[M-H]- 257.09432 156.5
[M+NH4]+ 276.13542 168.0
[M+K]+ 297.06476 162.0
[M+H-H2O]+ 241.09886 145.4
[M+HCOO]- 303.09980 171.3
[M+CH3COO]- 317.11545 193.4
[M+Na-2H]- 279.07627 153.7
[M]+ 258.10105 154.5
[M]- 258.10215 154.5
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.