CID 420644

6-(4-chlorophenoxy)pyridin-3-amine

Structural Information

Molecular Formula

C₁₁H₉ClN₂O

SMILES

C1=CC(=CC=C1OC2=NC=C(C=C2)N)Cl

InChI

InChI=1S/C11H9ClN2O/c12-8-1-4-10(5-2-8)15-11-6-3-9(13)7-14-11/h1-7H,13H2

InChIKey

POEUJOWYZVKVMS-UHFFFAOYSA-N

Compound name

6-(4-chlorophenoxy)pyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 32
Patents: 220.04034 Da
Monoisotopic Mass: 2.7
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]+	221.04762	144.7
[M+Na]+	243.02956	160.7
[M+NH4]+	238.07416	154.1
[M+K]+	259.00350	152.5
[M-H]-	219.03306	149.8
[M+Na-2H]-	241.01501	155.2
[M]+	220.03979	148.9
[M]-	220.04089	148.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe