CID 15207243

4-chloro-2,2'-bipyridine

Structural Information

Molecular Formula

C₁₀H₇ClN₂

SMILES

C1=CC=NC(=C1)C2=NC=CC(=C2)Cl

InChI

InChI=1S/C10H7ClN2/c11-8-4-6-13-10(7-8)9-3-1-2-5-12-9/h1-7H

InChIKey

IXEGJZGCPOORDR-UHFFFAOYSA-N

Compound name

4-chloro-2-pyridin-2-ylpyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 190.02977 Da
Monoisotopic Mass: 2.4
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]+	191.037046	136.1
[M+Na]+	213.018988	146.2
[M-H]-	189.022494	140.0
[M+NH4]+	208.063593	153.7
[M+K]+	228.992928	141.1
[M+H-H2O]+	173.027030	128.2
[M+HCOO]-	235.027971	154.4
[M+CH3COO]-	249.043621	149.6
[M+Na-2H]-	211.004436	145.3
[M]+	190.02922142	137.1
[M]-	190.03031858	137.1

Literature stripe

literature stripe

Patent stripe

patents stripe