CID 503164

(+/-)-1-(3-fluoro-4-hydroxymethyl-2,5-dihydrofuran-2-yl)-5-methylpyrimidine-2(1h), 4(3h)-dione

Structural Information

Molecular Formula
C10H11FN2O4
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C(=C(CO2)CO)F
InChI
InChI=1S/C10H11FN2O4/c1-5-2-13(10(16)12-8(5)15)9-7(11)6(3-14)4-17-9/h2,9,14H,3-4H2,1H3,(H,12,15,16)/t9-/m1/s1
InChIKey
UGGUMAAYLSPQLI-SECBINFHSA-N
Compound name
1-[(2R)-3-fluoro-4-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.07028 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.07756 147.9
[M+Na]+ 265.05950 159.2
[M-H]- 241.06300 150.1
[M+NH4]+ 260.10410 162.5
[M+K]+ 281.03344 156.0
[M+H-H2O]+ 225.06754 140.2
[M+HCOO]- 287.06848 166.4
[M+CH3COO]- 301.08413 186.3
[M+Na-2H]- 263.04495 150.1
[M]+ 242.06973 148.1
[M]- 242.07083 148.1
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.