CID 12703595

3-amino-5-methoxypyridine

Structural Information

Molecular Formula
C6H8N2O
SMILES
COC1=CN=CC(=C1)N
InChI
InChI=1S/C6H8N2O/c1-9-6-2-5(7)3-8-4-6/h2-4H,7H2,1H3
InChIKey
CTQPCFFQBYXOAJ-UHFFFAOYSA-N
Compound name
5-methoxypyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

766
Patents

124.06366 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 122.0
[M+Na]+ 147.05288 134.7
[M+NH4]+ 142.09748 130.7
[M+K]+ 163.02682 129.0
[M-H]- 123.05638 124.3
[M+Na-2H]- 145.03833 129.7
[M]+ 124.06311 124.4
[M]- 124.06421 124.4
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