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5-ACETYL-3,11-DIMETHYL-1,2,3,6-TETRAHYDRO-2,6-METHANOAZOCINO-[4,5-B]-INDOLE-1-SPIRO-2'-(1',3'-DITHIANE)
SpectraBase Compound ID 2AQMcl8n3OH
InChI InChI=1S/C21H24N2OS2/c1-13(24)16-12-22(2)18-11-15(16)19-14-7-4-5-8-17(14)23(3)20(19)21(18)25-9-6-10-26-21/h4-5,7-8,12,15,18H,6,9-11H2,1-3H3/t15-,18-/m0/s1
InChIKey RUNHEAASEQPWDI-YJBOKZPZSA-N
Mol Weight 384.56 g/mol
Molecular Formula C21H24N2OS2
Exact Mass 384.133006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J7NIs6ubozk
Name 5-ACETYL-3,11-DIMETHYL-1,2,3,6-TETRAHYDRO-2,6-METHANOAZOCINO-[4,5-B]-INDOLE-1-SPIRO-2'-(1',3'-DITHIANE)
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24N2OS2
InChI InChI=1S/C21H24N2OS2/c1-13(24)16-12-22(2)18-11-15(16)19-14-7-4-5-8-17(14)23(3)20(19)21(18)25-9-6-10-26-21/h4-5,7-8,12,15,18H,6,9-11H2,1-3H3/t15-,18-/m0/s1
InChIKey RUNHEAASEQPWDI-YJBOKZPZSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,57,2835(1992)
Literature Reference DOI 10.1021/jo00036a015
Molecular Weight 384.554 g/mol
Solvent CDCl3
Source File Reference UWCS3927