CID 453099

2-amino-ddp

Structural Information

Molecular Formula
C10H13N5O2
SMILES
C1C[C@@H](O[C@@H]1CO)N2C=NC3=CN=C(N=C32)N
InChI
InChI=1S/C10H13N5O2/c11-10-12-3-7-9(14-10)15(5-13-7)8-2-1-6(4-16)17-8/h3,5-6,8,16H,1-2,4H2,(H2,11,12,14)/t6-,8+/m0/s1
InChIKey
HXUIKBBUGWIQMV-POYBYMJQSA-N
Compound name
[(2S,5R)-5-(2-aminopurin-9-yl)oxolan-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3
Patents

235.10692 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.11420 149.5
[M+Na]+ 258.09614 159.4
[M-H]- 234.09964 152.0
[M+NH4]+ 253.14074 164.2
[M+K]+ 274.07008 156.7
[M+H-H2O]+ 218.10418 140.9
[M+HCOO]- 280.10512 168.3
[M+CH3COO]- 294.12077 161.4
[M+Na-2H]- 256.08159 153.3
[M]+ 235.10637 149.5
[M]- 235.10747 149.5
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

patents stripe