CID 132408

142130-73-2

Structural Information

Molecular Formula
C10H13N5O
SMILES
C1C[C@H](C[C@H]1N2C=NC3=C(N=CN=C32)N)O
InChI
InChI=1S/C10H13N5O/c11-9-8-10(13-4-12-9)15(5-14-8)6-1-2-7(16)3-6/h4-7,16H,1-3H2,(H2,11,12,13)/t6-,7+/m0/s1
InChIKey
UZNXSBPBWFLVDK-NKWVEPMBSA-N
Compound name
(1R,3S)-3-(6-aminopurin-9-yl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

18
Patents

219.11201 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.11929 146.4
[M+Na]+ 242.10123 156.4
[M-H]- 218.10473 148.3
[M+NH4]+ 237.14583 163.1
[M+K]+ 258.07517 152.2
[M+H-H2O]+ 202.10927 137.7
[M+HCOO]- 264.11021 166.0
[M+CH3COO]- 278.12586 158.4
[M+Na-2H]- 240.08668 149.8
[M]+ 219.11146 144.5
[M]- 219.11256 144.5
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