CID 514811

97975-00-3

Structural Information

Molecular Formula
C11H14N2O5
SMILES
C1COC2=NC(=O)N(C=C21)[C@H]3C[C@@H]([C@H](O3)CO)O
InChI
InChI=1S/C11H14N2O5/c14-5-8-7(15)3-9(18-8)13-4-6-1-2-17-10(6)12-11(13)16/h4,7-9,14-15H,1-3,5H2/t7-,8+,9+/m0/s1
InChIKey
QCIBQMMNYYRIGG-DJLDLDEBSA-N
Compound name
3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6-dihydrofuro[2,3-d]pyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

254.09027 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.09755 152.4
[M+Na]+ 277.07949 161.1
[M-H]- 253.08299 156.7
[M+NH4]+ 272.12409 167.4
[M+K]+ 293.05343 160.3
[M+H-H2O]+ 237.08753 146.6
[M+HCOO]- 299.08847 168.4
[M+CH3COO]- 313.10412 164.4
[M+Na-2H]- 275.06494 154.4
[M]+ 254.08972 153.3
[M]- 254.09082 153.3
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.