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3,5-Bis(phenylethynyl)-2,6-di-o-tolylpyridine
SpectraBase Compound ID LIN4fv9jsFJ
InChI InChI=1S/C35H25N/c1-26-13-9-11-19-32(26)34-30(23-21-28-15-5-3-6-16-28)25-31(24-22-29-17-7-4-8-18-29)35(36-34)33-20-12-10-14-27(33)2/h3-20,25H,1-2H3
InChIKey OGWUXVVDACUSBN-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 A3CuoFDLv3x
Name 3,5-Bis(phenylethynyl)-2,6-di-o-tolylpyridine
Appearance Light yellow solid
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Formula C35H25N
InChI InChI=1S/C35H25N/c1-26-13-9-11-19-32(26)34-30(23-21-28-15-5-3-6-16-28)25-31(24-22-29-17-7-4-8-18-29)35(36-34)33-20-12-10-14-27(33)2/h3-20,25H,1-2H3
InChIKey OGWUXVVDACUSBN-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)-c1c(cccc1)C)C#Cc1ccccc1)C#Cc1ccccc1)-c1c(cccc1)C
SPLASH splash10-0a4i-3121900000-cc7a624a2d3162324b23
Source of Spectrum ASC-361-SM11-3m
Wiley ID 1837992