CID 452035

Uridine, 2',3'-dideoxy-2',3'-difluoro-

Structural Information

Molecular Formula
C9H10F2N2O4
SMILES
C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)F)F
InChI
InChI=1S/C9H10F2N2O4/c10-6-4(3-14)17-8(7(6)11)13-2-1-5(15)12-9(13)16/h1-2,4,6-8,14H,3H2,(H,12,15,16)/t4-,6-,7-,8-/m1/s1
InChIKey
ZACSMWVJEMXZMV-XVFCMESISA-N
Compound name
1-[(2R,3S,4R,5R)-3,4-difluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

248.06087 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.06815 147.6
[M+Na]+ 271.05009 158.3
[M-H]- 247.05359 148.1
[M+NH4]+ 266.09469 161.7
[M+K]+ 287.02403 155.0
[M+H-H2O]+ 231.05813 139.1
[M+HCOO]- 293.05907 163.9
[M+CH3COO]- 307.07472 186.5
[M+Na-2H]- 269.03554 148.8
[M]+ 248.06032 144.9
[M]- 248.06142 144.9
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.