CID 6482280

3-(2-hydroxyethoxymethyl)furo[2,3-d]pyrimidin-2-one

Structural Information

Molecular Formula
C9H10N2O4
SMILES
C1=COC2=NC(=O)N(C=C21)COCCO
InChI
InChI=1S/C9H10N2O4/c12-2-4-14-6-11-5-7-1-3-15-8(7)10-9(11)13/h1,3,5,12H,2,4,6H2
InChIKey
DWFJVOKZRQTDFV-UHFFFAOYSA-N
Compound name
3-(2-hydroxyethoxymethyl)furo[2,3-d]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

210.06406 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07134 139.1
[M+Na]+ 233.05328 150.4
[M-H]- 209.05678 141.3
[M+NH4]+ 228.09788 156.5
[M+K]+ 249.02722 149.0
[M+H-H2O]+ 193.06132 132.3
[M+HCOO]- 255.06226 161.8
[M+CH3COO]- 269.07791 181.1
[M+Na-2H]- 231.03873 147.8
[M]+ 210.06351 145.6
[M]- 210.06461 145.6
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.