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2,6-Diphenyl-3,5-bis(m-tolylethynyl)pyridine
SpectraBase Compound ID LQ0Qitj7Mm
InChI InChI=1S/C35H25N/c1-26-11-9-13-28(23-26)19-21-32-25-33(22-20-29-14-10-12-27(2)24-29)35(31-17-7-4-8-18-31)36-34(32)30-15-5-3-6-16-30/h3-18,23-25H,1-2H3
InChIKey CLLRJJYUSPDGEF-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 3M7TrCoHycB
Name 2,6-Diphenyl-3,5-bis(m-tolylethynyl)pyridine
Appearance Colorless solid
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Formula C35H25N
InChI InChI=1S/C35H25N/c1-26-11-9-13-28(23-26)19-21-32-25-33(22-20-29-14-10-12-27(2)24-29)35(31-17-7-4-8-18-31)36-34(32)30-15-5-3-6-16-30/h3-18,23-25H,1-2H3
InChIKey CLLRJJYUSPDGEF-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#Cc1cc(ccc1)C)C#Cc1cc(ccc1)C)-c1ccccc1
SPLASH splash10-0a4i-0010900000-7b942a74f850e13648eb
Source of Spectrum ASC-361-SM9-3h
Wiley ID 1837987