CID 65275

2-amino-6-methoxypurine

Structural Information

Molecular Formula
C6H7N5O
SMILES
COC1=NC(=NC2=C1NC=N2)N
InChI
InChI=1S/C6H7N5O/c1-12-5-3-4(9-2-8-3)10-6(7)11-5/h2H,1H3,(H3,7,8,9,10,11)
InChIKey
BXJHWYVXLGLDMZ-UHFFFAOYSA-N
Compound name
6-methoxy-7H-purin-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

989
References

8655
Patents

165.06506 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.07234 130.6
[M+Na]+ 188.05428 143.2
[M+NH4]+ 183.09888 137.4
[M+K]+ 204.02822 140.4
[M-H]- 164.05778 130.2
[M+Na-2H]- 186.03973 136.5
[M]+ 165.06451 132.0
[M]- 165.06561 132.0
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