CID 50988282

4-(azetidin-3-yloxy)pyridine dihydrochloride

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

C1C(CN1)OC2=CC=NC=C2

InChI

InChI=1S/C8H10N2O/c1-3-9-4-2-7(1)11-8-5-10-6-8/h1-4,8,10H,5-6H2

InChIKey

RLQYIYTUKIVZKO-UHFFFAOYSA-N

Compound name

4-(azetidin-3-yloxy)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 97
Patents: 150.07932 Da
Monoisotopic Mass: 0.2
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]+	151.08660	126.6
[M+Na]+	173.06854	132.7
[M-H]-	149.07204	128.8
[M+NH4]+	168.11314	137.8
[M+K]+	189.04248	133.4
[M+H-H2O]+	133.07658	114.0
[M+HCOO]-	195.07752	146.0
[M+CH3COO]-	209.09317	174.9
[M+Na-2H]-	171.05399	134.8
[M]+	150.07877	132.6
[M]-	150.07987	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe