CID 487682

222737-82-8

Structural Information

Molecular Formula
C11H15N5O4
SMILES
CCOC1=NC(=O)C=CN1[C@H]2C[C@@H]([C@H](O2)CN=[N+]=[N-])O
InChI
InChI=1S/C11H15N5O4/c1-2-19-11-14-9(18)3-4-16(11)10-5-7(17)8(20-10)6-13-15-12/h3-4,7-8,10,17H,2,5-6H2,1H3/t7-,8+,10+/m0/s1
InChIKey
ONLIRFNQXICNBW-QXFUBDJGSA-N
Compound name
1-[(2R,4S,5R)-5-(azidomethyl)-4-hydroxyoxolan-2-yl]-2-ethoxypyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.1124 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.11968 160.9
[M+Na]+ 304.10162 167.8
[M-H]- 280.10512 167.4
[M+NH4]+ 299.14622 174.0
[M+K]+ 320.07556 161.9
[M+H-H2O]+ 264.10966 156.2
[M+HCOO]- 326.11060 186.7
[M+CH3COO]- 340.12625 198.7
[M+Na-2H]- 302.08707 168.6
[M]+ 281.11185 160.5
[M]- 281.11295 160.5
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.