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3',6-Dibromo-6'-chloro-[2,2'-bipyridine]-3-carbonitrile
SpectraBase Compound ID 1vpuOdn6ile
InChI InChI=1S/C11H4Br2ClN3/c12-7-2-4-9(14)17-11(7)10-6(5-15)1-3-8(13)16-10/h1-4H
InChIKey BDQJTGPAUKTNPL-UHFFFAOYSA-N
Mol Weight 373.44 g/mol
Molecular Formula C11H4Br2ClN3
Exact Mass 370.846051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AR5HyrQEg2c
Name 3',6-Dibromo-6'-chloro-[2,2'-bipyridine]-3-carbonitrile
Appearance White solid
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Formula C11H4Br2ClN3
InChI InChI=1S/C11H4Br2ClN3/c12-7-2-4-9(14)17-11(7)10-6(5-15)1-3-8(13)16-10/h1-4H
InChIKey BDQJTGPAUKTNPL-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201915425
Molecular Weight 373.435 g/mol
SMILES c1cc(c(nc1Cl)-c1nc(ccc1C#N)Br)Br
SPLASH splash10-0006-0195000000-5a14abecf9baf21f1fc8
Source of Spectrum ACI-59-SM61-43
Thin-Layer Chromatography Rf = 0.37 (Hexanes/EtOAc, 5:1)
Wiley ID 1857818