CID 42552995

6,6'-dichloro-3,3'-bipyridine

Structural Information

Molecular Formula

C₁₀H₆Cl₂N₂

SMILES

C1=CC(=NC=C1C2=CN=C(C=C2)Cl)Cl

InChI

InChI=1S/C10H6Cl2N2/c11-9-3-1-7(5-13-9)8-2-4-10(12)14-6-8/h1-6H

InChIKey

XKIAROROTBNXKZ-UHFFFAOYSA-N

Compound name

2-chloro-5-(6-chloropyridin-3-yl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 223.9908 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]+	224.99808	143.6
[M+Na]+	246.98002	162.0
[M+NH4]+	242.02462	153.5
[M+K]+	262.95396	152.4
[M-H]-	222.98352	148.1
[M+Na-2H]-	244.96547	154.9
[M]+	223.99025	148.4
[M]-	223.99135	148.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe