CID 475257

1-[2-(2-hydroxyethyl)tetrahydrofuran-3-yl]pyrimidine-2,4-dione

Structural Information

Molecular Formula
C10H14N2O4
SMILES
C1COC(C1N2C=CC(=O)NC2=O)CCO
InChI
InChI=1S/C10H14N2O4/c13-5-2-8-7(3-6-16-8)12-4-1-9(14)11-10(12)15/h1,4,7-8,13H,2-3,5-6H2,(H,11,14,15)
InChIKey
SIZQWJOTERILIN-UHFFFAOYSA-N
Compound name
1-[2-(2-hydroxyethyl)oxolan-3-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

226.09535 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10263 146.9
[M+Na]+ 249.08457 155.3
[M-H]- 225.08807 149.3
[M+NH4]+ 244.12917 161.5
[M+K]+ 265.05851 152.7
[M+H-H2O]+ 209.09261 139.6
[M+HCOO]- 271.09355 165.0
[M+CH3COO]- 285.10920 181.4
[M+Na-2H]- 247.07002 150.1
[M]+ 226.09480 145.9
[M]- 226.09590 145.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.