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]+ 255.097546 152.4
[M+Na]+ 277.079488 161.1
[M-H]- 253.082994 156.7
[M+NH4]+ 272.124093 167.4
[M+K]+ 293.053428 160.3
[M+H-H2O]+ 237.087530 146.6
[M+HCOO]- 299.088471 168.4
[M+CH3COO]- 313.104121 164.4
[M+Na-2H]- 275.064936 154.4
[M]+ 254.08972142 153.3
[M]- 254.09081858 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.