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2,3,5-Trichloro-4,6-bis(4-cyanophenyl)pyridine
SpectraBase Compound ID C6fZAhuU0Fe
InChI InChI=1S/C19H8Cl3N3/c20-16-15(13-5-1-11(9-23)2-6-13)17(21)19(22)25-18(16)14-7-3-12(10-24)4-8-14/h1-8H
InChIKey BIZVPKMKGMMEAT-UHFFFAOYSA-N
Mol Weight 384.65 g/mol
Molecular Formula C19H8Cl3N3
Exact Mass 382.97838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LXch6WcKAUo
Name 2,3,5-Trichloro-4,6-bis(4-cyanophenyl)pyridine
Appearance White solid
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Exact Mass 382.978380370 u
Formula C19H8Cl3N3
InChI InChI=1S/C19H8Cl3N3/c20-16-15(13-5-1-11(9-23)2-6-13)17(21)19(22)25-18(16)14-7-3-12(10-24)4-8-14/h1-8H
InChIKey BIZVPKMKGMMEAT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701718
Molecular Weight 384.653 g/mol
Quality 635
Reported Formula C19H8N3Cl3
SMILES C=1(Cl)C(=C(C(=NC1C1=CC=C(C#N)C=C1)Cl)Cl)C1=CC=C(C=C1)C#N
SPLASH splash10-0f81-0329000000-f004e837b9bb21cbe88d
Source of Spectrum K1-2018-998-5d (DOI: 10.1002/ejoc.201701718)
Wiley ID 1891826