CID 44438827

4'-vinyluridine

Structural Information

Molecular Formula
C11H14N2O6
SMILES
C=C[C@]1([C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O)CO
InChI
InChI=1S/C11H14N2O6/c1-2-11(5-14)8(17)7(16)9(19-11)13-4-3-6(15)12-10(13)18/h2-4,7-9,14,16-17H,1,5H2,(H,12,15,18)/t7-,8+,9-,11-/m1/s1
InChIKey
PWIFWRFGPRGJAD-PKIKSRDPSA-N
Compound name
1-[(2R,3R,4S,5R)-5-ethenyl-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

270.08517 Da
Monoisotopic Mass

-1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.09245 155.4
[M+Na]+ 293.07439 165.0
[M-H]- 269.07789 156.0
[M+NH4]+ 288.11899 169.1
[M+K]+ 309.04833 161.6
[M+H-H2O]+ 253.08243 149.6
[M+HCOO]- 315.08337 170.6
[M+CH3COO]- 329.09902 186.3
[M+Na-2H]- 291.05984 157.6
[M]+ 270.08462 154.6
[M]- 270.08572 154.6
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

patents stripe