CID 6426300

147496-14-8

Structural Information

Molecular Formula

C₁₀H₆Br₂N₂

SMILES

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

InChI

InChI=1S/C10H6Br2N2/c11-9-3-1-7(5-13-9)8-2-4-10(12)14-6-8/h1-6H

InChIKey

IJTQXCQPBVBRSV-UHFFFAOYSA-N

Compound name

2-bromo-5-(6-bromopyridin-3-yl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 311.88977 Da
Monoisotopic Mass: 3.5
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]+	312.89705	149.9
[M+Na]+	334.87899	147.1
[M+NH4]+	329.92359	152.3
[M+K]+	350.85293	152.4
[M-H]-	310.88249	151.9
[M+Na-2H]-	332.86444	153.8
[M]+	311.88922	149.1
[M]-	311.89032	149.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe