CID 451393

111495-91-1

Structural Information

Molecular Formula
C10H13N5O5
SMILES
COC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]
InChI
InChI=1S/C10H13N5O5/c1-19-6-3-15(10(18)12-9(6)17)8-2-5(13-14-11)7(4-16)20-8/h3,5,7-8,16H,2,4H2,1H3,(H,12,17,18)/t5-,7+,8+/m0/s1
InChIKey
FAAWHRBQBGUHAV-UIISKDMLSA-N
Compound name
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methoxypyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

283.09167 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.09895 158.8
[M+Na]+ 306.08089 166.5
[M-H]- 282.08439 164.5
[M+NH4]+ 301.12549 171.1
[M+K]+ 322.05483 159.9
[M+H-H2O]+ 266.08893 154.6
[M+HCOO]- 328.08987 183.6
[M+CH3COO]- 342.10552 195.9
[M+Na-2H]- 304.06634 166.1
[M]+ 283.09112 157.3
[M]- 283.09222 157.3
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.