CID 58770022

6-cyclobutoxypyridin-3-amine

Structural Information

Molecular Formula
C9H12N2O
SMILES
C1CC(C1)OC2=NC=C(C=C2)N
InChI
InChI=1S/C9H12N2O/c10-7-4-5-9(11-6-7)12-8-2-1-3-8/h4-6,8H,1-3,10H2
InChIKey
JRBXTNBZQGKGBX-UHFFFAOYSA-N
Compound name
6-cyclobutyloxypyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

141
Patents

164.09496 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 131.6
[M+Na]+ 187.084178 137.4
[M-H]- 163.087684 136.2
[M+NH4]+ 182.128783 143.8
[M+K]+ 203.058118 138.7
[M+H-H2O]+ 147.092220 118.9
[M+HCOO]- 209.093161 153.7
[M+CH3COO]- 223.108811 182.8
[M+Na-2H]- 185.069626 138.1
[M]+ 164.09441142 137.8
[M]- 164.09550858 137.8
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

patents stripe