CID 20039

2',3'-dideoxyadenosine

Structural Information

Molecular Formula

C₁₀H₁₃N₅O₂

SMILES

C1C[C@@H](O[C@@H]1CO)N2C=NC3=C(N=CN=C32)N

InChI

InChI=1S/C10H13N5O2/c11-9-8-10(13-4-12-9)15(5-14-8)7-2-1-6(3-16)17-7/h4-7,16H,1-3H2,(H2,11,12,13)/t6-,7+/m0/s1

InChIKey

WVXRAFOPTSTNLL-NKWVEPMBSA-N

Compound name

[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 507
References: 16771
Patents: 235.10692 Da
Monoisotopic Mass: -0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	236.11420	149.8
[M+Na]+	258.09614	161.1
[M+NH4]+	253.14074	156.1
[M+K]+	274.07008	160.9
[M-H]-	234.09964	151.9
[M+Na-2H]-	256.08159	154.0
[M]+	235.10637	151.6
[M]-	235.10747	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe