CID 453479

Cis-4-(6-amino-9h-purin-9-yl)-d-prolinol

Structural Information

Molecular Formula
C10H14N6O
SMILES
C1[C@H](CN[C@H]1CO)N2C=NC3=C(N=CN=C32)N
InChI
InChI=1S/C10H14N6O/c11-9-8-10(14-4-13-9)16(5-15-8)7-1-6(3-17)12-2-7/h4-7,12,17H,1-3H2,(H2,11,13,14)/t6-,7-/m1/s1
InChIKey
LIMGOFPYHUEMJW-RNFRBKRXSA-N
Compound name
[(2R,4R)-4-(6-aminopurin-9-yl)pyrrolidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

234.12291 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.13019 151.3
[M+Na]+ 257.11213 160.8
[M-H]- 233.11563 150.6
[M+NH4]+ 252.15673 165.3
[M+K]+ 273.08607 155.7
[M+H-H2O]+ 217.12017 142.1
[M+HCOO]- 279.12111 168.0
[M+CH3COO]- 293.13676 161.8
[M+Na-2H]- 255.09758 154.1
[M]+ 234.12236 148.1
[M]- 234.12346 148.1
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.