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1,10,13-TRIPHENYL-12-OXA-11-THIA-13-AZATETRACYClO-[8.2.2.0(2,9).0(3,8)]-TETRADECA-3,5,7-TRIEN-12-ONE

Compound with spectra: 1 NMR, and 1 MS (GC)

1,10,13-TRIPHENYL-12-OXA-11-THIA-13-AZATETRACYClO-[8.2.2.0(2,9).0(3,8)]-TETRADECA-3,5,7-TRIEN-12-ONE
SpectraBase Compound ID IjAaXOuuSdJ
InChI InChI=1S/C29H21NO2S/c31-27-28(20-12-4-1-5-13-20)25-23-18-10-11-19-24(23)26(25)29(32-33-28,21-14-6-2-7-15-21)30(27)22-16-8-3-9-17-22/h1-19,25-26H
InChIKey KVSJVROAXMHDPM-UHFFFAOYSA-N
Mol Weight 447.55 g/mol
Molecular Formula C29H21NO2S
Exact Mass 447.1293 g/mol

View Spectrum of 1,10,13-TRIPHENYL-12-OXA-11-THIA-13-AZATETRACYClO-[8.2.2.0(2,9).0(3,8)]-TETRADECA-3,5,7-TRIEN-12-ONE

MS (GC) Spectrum
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Source of Spectrum KC-1993-1059-36

View Spectrum of 1,10,13-TRIPHENYL-12-OXA-11-THIA-13-AZATETRACYClO-[8.2.2.0(2,9).0(3,8)]-TETRADECA-3,5,7-TRIEN-12-ONE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 1,10,13-Triphenyl-12-oxa-11-thia-13-azatetracyclo[8.2.1.0(2,9),0(3,8)]trideca-3,5,7-trien-14-one
Title Journal or Book Year
Heterocycles by cycloaddition. Part 10. Cycloaddition–extrusion–ring expansion of mesoionic compounds with benzocyclobutene. Approaches to seven- and eight-membered fully conjugated systems J. Chem. Soc., Perkin Trans. 1 1993
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