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3,5-Bis((3-chlorophenyl)ethynyl)-2,6-diphenylpyridine
SpectraBase Compound ID 7TWmzqrHb0j
InChI InChI=1S/C33H19Cl2N/c34-30-15-7-9-24(21-30)17-19-28-23-29(20-18-25-10-8-16-31(35)22-25)33(27-13-5-2-6-14-27)36-32(28)26-11-3-1-4-12-26/h1-16,21-23H
InChIKey LCXMKRXSSGHFPU-UHFFFAOYSA-N
Mol Weight 500.4 g/mol
Molecular Formula C33H19Cl2N
Exact Mass 499.089455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DxDKlgg0Ma3
Name 3,5-Bis((3-chlorophenyl)ethynyl)-2,6-diphenylpyridine
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H19Cl2N
InChI InChI=1S/C33H19Cl2N/c34-30-15-7-9-24(21-30)17-19-28-23-29(20-18-25-10-8-16-31(35)22-25)33(27-13-5-2-6-14-27)36-32(28)26-11-3-1-4-12-26/h1-16,21-23H
InChIKey LCXMKRXSSGHFPU-UHFFFAOYSA-N
Instrument Name Agilent 6890/5973 or Agilent 7890/5977
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900034
Molecular Weight 500.428 g/mol
Reported Formula C33H19N(35)Cl2
SMILES c1(c(cc(c(n1)-c1ccccc1)C#Cc1cc(ccc1)Cl)C#Cc1cc(ccc1)Cl)-c1ccccc1
SPLASH splash10-0udj-0011960000-de868eb578447a1c398f
Source of Spectrum ASC-361-SM9-3i
Wiley ID 1837988