CID 510981

[(2s,5r)-5-(6-amino-2-azido-purin-9-yl)-2,5-dihydrofuran-2-yl]methanol

Structural Information

Molecular Formula
C10H10N8O2
SMILES
C1=C[C@@H](O[C@@H]1CO)N2C=NC3=C(N=C(N=C32)N=[N+]=[N-])N
InChI
InChI=1S/C10H10N8O2/c11-8-7-9(15-10(14-8)16-17-12)18(4-13-7)6-2-1-5(3-19)20-6/h1-2,4-6,19H,3H2,(H2,11,14,15)/t5-,6+/m0/s1
InChIKey
KMJYXVBHRATEQW-NTSWFWBYSA-N
Compound name
[(2S,5R)-5-(6-amino-2-azidopurin-9-yl)-2,5-dihydrofuran-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

274.09268 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.09996 154.3
[M+Na]+ 297.08190 163.6
[M-H]- 273.08540 160.3
[M+NH4]+ 292.12650 167.3
[M+K]+ 313.05584 156.2
[M+H-H2O]+ 257.08994 148.8
[M+HCOO]- 319.09088 181.0
[M+CH3COO]- 333.10653 199.6
[M+Na-2H]- 295.06735 164.8
[M]+ 274.09213 153.4
[M]- 274.09323 153.4
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.