CID 451914

C-2'-az-dda

Structural Information

Molecular Formula
C11H14N8O
SMILES
C1[C@H](C[C@H]([C@@H]1N=[N+]=[N-])N2C=NC3=C(N=CN=C32)N)CO
InChI
InChI=1S/C11H14N8O/c12-10-9-11(15-4-14-10)19(5-16-9)8-2-6(3-20)1-7(8)17-18-13/h4-8,20H,1-3H2,(H2,12,14,15)/t6-,7-,8-/m1/s1
InChIKey
QUQLKYBHKAOCCE-BWZBUEFSSA-N
Compound name
[(1S,3R,4R)-3-(6-aminopurin-9-yl)-4-azidocyclopentyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

274.12906 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13634 155.1
[M+Na]+ 297.11828 163.0
[M-H]- 273.12178 159.9
[M+NH4]+ 292.16288 169.4
[M+K]+ 313.09222 154.5
[M+H-H2O]+ 257.12632 149.3
[M+HCOO]- 319.12726 180.9
[M+CH3COO]- 333.14291 200.5
[M+Na-2H]- 295.10373 163.8
[M]+ 274.12851 151.3
[M]- 274.12961 151.3
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.