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5,6,7,8,10,11,12,13,18,19,20,21-DODECAHYDRODIBENZO-[F,1]-[1,4,8,11,15]-THIATETRAAZACYCLOHEPTADECINE
SpectraBase Compound ID 3w3kN1ijRC4
InChI InChI=1S/C20H28N4S/c1-3-7-19-17(5-1)15-21-11-13-25-14-12-22-16-18-6-2-4-8-20(18)24-10-9-23-19/h1-8,21-24H,9-16H2
InChIKey AUTOMNZQVSIKPB-UHFFFAOYSA-N
Mol Weight 356.53 g/mol
Molecular Formula C20H28N4S
Exact Mass 356.203468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Diy071ZvzWh
Name 5,6,7,8,10,11,12,13,18,19,20,21-DODECAHYDRODIBENZO-[F,1]-[1,4,8,11,15]-THIATETRAAZACYCLOHEPTADECINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N4S
InChI InChI=1S/C20H28N4S/c1-3-7-19-17(5-1)15-21-11-13-25-14-12-22-16-18-6-2-4-8-20(18)24-10-9-23-19/h1-8,21-24H,9-16H2
InChIKey AUTOMNZQVSIKPB-UHFFFAOYSA-N
Literature Reference Author P.A.DUCKWORTH,L.F.LINDOY,M.MCPARTLIN,P.A.TASKER
Literature Reference Citation AUSTR.J.CHEM.,46,1787(1993)
Literature Reference DOI 10.1071/ch9931787
Molecular Weight 356.529 g/mol
Solvent CDCl3
Source File Reference UWRK1175