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2,6-Diphenyl-3,5-bis(p-tolylethynyl)pyridine
SpectraBase Compound ID BrWcR44w8T1
InChI InChI=1S/C35H25N/c1-26-13-17-28(18-14-26)21-23-32-25-33(24-22-29-19-15-27(2)16-20-29)35(31-11-7-4-8-12-31)36-34(32)30-9-5-3-6-10-30/h3-20,25H,1-2H3
InChIKey YEWZXXFSEMIXOM-UHFFFAOYSA-N
Mol Weight 459.6 g/mol
Molecular Formula C35H25N
Exact Mass 459.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPNpqUPbR2q
Name 2,6-Diphenyl-3,5-bis(p-tolylethynyl)pyridine
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H25N
InChI InChI=1S/C35H25N/c1-26-13-17-28(18-14-26)21-23-32-25-33(24-22-29-19-15-27(2)16-20-29)35(31-11-7-4-8-12-31)36-34(32)30-9-5-3-6-10-30/h3-20,25H,1-2H3
InChIKey YEWZXXFSEMIXOM-UHFFFAOYSA-N
Instrument Name Agilent 6890/5973 or Agilent 7890/5977
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900034
Molecular Weight 459.592 g/mol
Reported Formula C35H25N
SMILES c1(c(cc(c(n1)-c1ccccc1)C#Cc1ccc(cc1)C)C#Cc1ccc(cc1)C)-c1ccccc1
SPLASH splash10-0a4i-0000900000-710fd9e621f44c20a1f4
Source of Spectrum ASC-361-SM7-3b
Wiley ID 1837981