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(2R,3S,11BS/2S,3R,11BR)-2-(6,7-DIMETHOXYISOQUINOLIN-1-YL-METHYL)-3-ETHYL-9,10-DIMETHOXY-1,3,4,6,7,11B-HEXAHYDRO-2H-BENZO-[A]-QUINOLIZINE

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(2R,3S,11BS/2S,3R,11BR)-2-(6,7-DIMETHOXYISOQUINOLIN-1-YL-METHYL)-3-ETHYL-9,10-DIMETHOXY-1,3,4,6,7,11B-HEXAHYDRO-2H-BENZO-[A]-QUINOLIZINE
SpectraBase Compound ID 5IpCRyaes4h
InChI InChI=1S/C29H36N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h7,9,13-16,18,21,25H,6,8,10-12,17H2,1-5H3/t18-,21+,25+/m1/s1
InChIKey MBYXEBXZARTUSS-QLWBXOBMSA-N
Mol Weight 476.6 g/mol
Molecular Formula C29H36N2O4
Exact Mass 476.267508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EU1alcjQxxP
Name (2R,3S,11BS/2S,3R,11BR)-2-(6,7-DIMETHOXYISOQUINOLIN-1-YL-METHYL)-3-ETHYL-9,10-DIMETHOXY-1,3,4,6,7,11B-HEXAHYDRO-2H-BENZO-[A]-QUINOLIZINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36N2O4
InChI InChI=1S/C29H36N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h7,9,13-16,18,21,25H,6,8,10-12,17H2,1-5H3/t18-,21+,25+/m1/s1
InChIKey MBYXEBXZARTUSS-QLWBXOBMSA-N
Literature Reference Author E.REIMANN,M.RENZ
Literature Reference Citation MH.CHEM.,138,211(2007)
Literature Reference DOI 10.1007/s00706-007-0601-x
Molecular Weight 476.616 g/mol
Sample ID 68543
Solvent CDCl3