CID 62115805

2-cyclobutoxypyridin-3-amine

Structural Information

Molecular Formula

C₉H₁₂N₂O

SMILES

C1CC(C1)OC2=C(C=CC=N2)N

InChI

InChI=1S/C9H12N2O/c10-8-5-2-6-11-9(8)12-7-3-1-4-7/h2,5-7H,1,3-4,10H2

InChIKey

UTGQTONRWQTGRQ-UHFFFAOYSA-N

Compound name

2-cyclobutyloxypyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 164.09496 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[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

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe