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METHYL-4-ALPHA-ETHYL-2-(2-HYDROXYETHYL)-11-METHYL-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
SpectraBase Compound ID 89dRls23nyQ
InChI InChI=1S/C21H28N2O3/c1-4-13-12-23(9-10-24)17-11-15(13)19(21(25)26-3)18-14-7-5-6-8-16(14)22(2)20(17)18/h5-8,13,15,17,19,24H,4,9-12H2,1-3H3/t13-,15+,17+,19+/m1/s1
InChIKey LAEDNUXRLBVBFX-UJNZZBMASA-N
Mol Weight 356.47 g/mol
Molecular Formula C21H28N2O3
Exact Mass 356.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMCPVYDThBF
Name METHYL-4-ALPHA-ETHYL-2-(2-HYDROXYETHYL)-11-METHYL-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
Compound Number 41
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O3
InChI InChI=1S/C21H28N2O3/c1-4-13-12-23(9-10-24)17-11-15(13)19(21(25)26-3)18-14-7-5-6-8-16(14)22(2)20(17)18/h5-8,13,15,17,19,24H,4,9-12H2,1-3H3/t13-,15+,17+,19+/m1/s1
InChIKey LAEDNUXRLBVBFX-UJNZZBMASA-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 356.465 g/mol
Solvent CDCl3
Source File Reference UWGE1568