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2,6-Bis(3-fluorophenyl)-3,5-bis(phenylethynyl)pyridine
SpectraBase Compound ID 4XhVStMFlbR
InChI InChI=1S/C33H19F2N/c34-30-15-7-13-26(22-30)32-28(19-17-24-9-3-1-4-10-24)21-29(20-18-25-11-5-2-6-12-25)33(36-32)27-14-8-16-31(35)23-27/h1-16,21-23H
InChIKey WBUISBHBSGYMLV-UHFFFAOYSA-N
Mol Weight 467.5 g/mol
Molecular Formula C33H19F2N
Exact Mass 467.148556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ce1YOSb3yu6
Name 2,6-Bis(3-fluorophenyl)-3,5-bis(phenylethynyl)pyridine
Appearance Off-white solid
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Formula C33H19F2N
InChI InChI=1S/C33H19F2N/c34-30-15-7-13-26(22-30)32-28(19-17-24-9-3-1-4-10-24)21-29(20-18-25-11-5-2-6-12-25)33(36-32)27-14-8-16-31(35)23-27/h1-16,21-23H
InChIKey WBUISBHBSGYMLV-UHFFFAOYSA-N
Instrument Name Agilent 6890/5973 or Agilent 7890/5977
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900034
Molecular Weight 467.519 g/mol
Reported Formula C33H19F2N
SMILES c1(c(cc(c(n1)-c1cc(ccc1)F)C#Cc1ccccc1)C#Cc1ccccc1)-c1cc(ccc1)F
SPLASH splash10-014i-1000900000-24b1e805e37e84799d63
Source of Spectrum ASC-361-SM11-3n
Wiley ID 1837993