CID 5271959

123882-02-0

Structural Information

Molecular Formula
C11H14N2O6
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=C3C(COC3=NC2=O)O)CO)O
InChI
InChI=1S/C11H14N2O6/c14-3-8-6(15)1-9(19-8)13-2-5-7(16)4-18-10(5)12-11(13)17/h2,6-9,14-16H,1,3-4H2/t6-,7?,8+,9+/m0/s1
InChIKey
RBMXQTDFSIKBKL-KKVHJZIVSA-N
Compound name
5-hydroxy-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

270.08517 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.09245 155.6
[M+Na]+ 293.07439 164.4
[M-H]- 269.07789 159.0
[M+NH4]+ 288.11899 169.5
[M+K]+ 309.04833 163.5
[M+H-H2O]+ 253.08243 150.2
[M+HCOO]- 315.08337 170.2
[M+CH3COO]- 329.09902 189.0
[M+Na-2H]- 291.05984 156.8
[M]+ 270.08462 156.6
[M]- 270.08572 156.6
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.