CID 484355

1-[(2r)-4-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidine-2,4-dione

Structural Information

Molecular Formula
C9H10N2O4
SMILES
C1C(=C[C@@H](O1)N2C=CC(=O)NC2=O)CO
InChI
InChI=1S/C9H10N2O4/c12-4-6-3-8(15-5-6)11-2-1-7(13)10-9(11)14/h1-3,8,12H,4-5H2,(H,10,13,14)/t8-/m1/s1
InChIKey
GBUBYWMTOZKBAI-MRVPVSSYSA-N
Compound name
1-[(2R)-4-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

210.06406 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07134 140.7
[M+Na]+ 233.05328 150.6
[M-H]- 209.05678 143.7
[M+NH4]+ 228.09788 156.0
[M+K]+ 249.02722 148.0
[M+H-H2O]+ 193.06132 133.6
[M+HCOO]- 255.06226 160.6
[M+CH3COO]- 269.07791 178.0
[M+Na-2H]- 231.03873 145.4
[M]+ 210.06351 140.8
[M]- 210.06461 140.8
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.