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METHYL-4(E)-ETHYLIDENE-11-METHYL-2-(PARA-METHOXYBENZYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
SpectraBase Compound ID 3WNVE1Kw9h8
InChI InChI=1S/C27H30N2O3/c1-5-18-16-29(15-17-10-12-19(31-3)13-11-17)23-14-21(18)25(27(30)32-4)24-20-8-6-7-9-22(20)28(2)26(23)24/h5-13,21,23,25H,14-16H2,1-4H3/b18-5-/t21-,23-,25-/m0/s1
InChIKey GNPOPCJINDPTAL-RNDNUXNNSA-N
Mol Weight 430.55 g/mol
Molecular Formula C27H30N2O3
Exact Mass 430.225643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ZJbKywtK2W
Name METHYL-4(E)-ETHYLIDENE-11-METHYL-2-(PARA-METHOXYBENZYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
Compound Number 30A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H30N2O3
InChI InChI=1S/C27H30N2O3/c1-5-18-16-29(15-17-10-12-19(31-3)13-11-17)23-14-21(18)25(27(30)32-4)24-20-8-6-7-9-22(20)28(2)26(23)24/h5-13,21,23,25H,14-16H2,1-4H3/b18-5-/t21-,23-,25-/m0/s1
InChIKey GNPOPCJINDPTAL-RNDNUXNNSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,A.RAMIREZ,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,61,1239(1996)
Literature Reference DOI 10.1021/jo951456f
Molecular Weight 430.547 g/mol
Solvent CDCl3
Source File Reference UWGE1559