CID 20382063

2-chloro-5-phenoxy-pyridine

Structural Information

Molecular Formula

C₁₁H₈ClNO

SMILES

C1=CC=C(C=C1)OC2=CN=C(C=C2)Cl

InChI

InChI=1S/C11H8ClNO/c12-11-7-6-10(8-13-11)14-9-4-2-1-3-5-9/h1-8H

InChIKey

FYMYERCFXFLAJI-UHFFFAOYSA-N

Compound name

2-chloro-5-phenoxypyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 205.02943 Da
Monoisotopic Mass: 3.3
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]+	206.036706	139.5
[M+Na]+	228.018648	149.2
[M-H]-	204.022154	144.9
[M+NH4]+	223.063253	157.9
[M+K]+	243.992588	144.5
[M+H-H2O]+	188.026690	132.4
[M+HCOO]-	250.027631	159.2
[M+CH3COO]-	264.043281	153.2
[M+Na-2H]-	226.004096	148.1
[M]+	205.02888142	141.9
[M]-	205.02997858	141.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe