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2-AZA-5,7-DIPHENYL-8-THIA-4-THIAPHENYL-TRICYCLO-[7.4.0.0(2,5)]-TRIDECA-DELTA(1,9),10,12-TRIEN-3-ONE
SpectraBase Compound ID 7yFACnwPsNp
InChI InChI=1S/C27H21NOS2/c29-26-25(23-16-9-17-30-23)27(20-12-5-2-6-13-20)18-24(19-10-3-1-4-11-19)31-22-15-8-7-14-21(22)28(26)27/h1-17,24-25H,18H2
InChIKey LYMRWUGMOJCBHF-UHFFFAOYSA-N
Mol Weight 439.59 g/mol
Molecular Formula C27H21NOS2
Exact Mass 439.106457 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GlILnce641K
Name 2-AZA-5,7-DIPHENYL-8-THIA-4-THIAPHENYL-TRICYCLO-[7.4.0.0(2,5)]-TRIDECA-DELTA(1,9),10,12-TRIEN-3-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H21NOS2
InChI InChI=1S/C27H21NOS2/c29-26-25(23-16-9-17-30-23)27(20-12-5-2-6-13-20)18-24(19-10-3-1-4-11-19)31-22-15-8-7-14-21(22)28(26)27/h1-17,24-25H,18H2
InChIKey LYMRWUGMOJCBHF-UHFFFAOYSA-N
Literature Reference Author A.SZOELLOESY,G.KOTOVYCH,G.TOTH,A.LEVAI
Literature Reference Citation CAN.J.CHEM.,66,279(1988)
Literature Reference DOI 10.1139/v88-047
Molecular Weight 439.590 g/mol
Solvent CDCl3
Source File Reference UWED3202