CID 165997086

9-(4-methoxypyrimidin-2-yl)-9h-purin-6-amine

Structural Information

Molecular Formula
C10H9N7O
SMILES
COC1=NC(=NC=C1)N2C=NC3=C(N=CN=C32)N
InChI
InChI=1S/C10H9N7O/c1-18-6-2-3-12-10(16-6)17-5-15-7-8(11)13-4-14-9(7)17/h2-5H,1H3,(H2,11,13,14)
InChIKey
AAUKLIWPYPVJCQ-UHFFFAOYSA-N
Compound name
9-(4-methoxypyrimidin-2-yl)purin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.08685 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.09413 151.2
[M+Na]+ 266.07607 166.4
[M+NH4]+ 261.12067 157.1
[M+K]+ 282.05001 162.7
[M-H]- 242.07957 152.5
[M+Na-2H]- 264.06152 159.5
[M]+ 243.08630 153.6
[M]- 243.08740 153.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.