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METHYL-(1RS,5SR,6SR)-4-(E)-ETHYLIDENE-2-(2-HYDROXYETHYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-CARBOXYLATE

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METHYL-(1RS,5SR,6SR)-4-(E)-ETHYLIDENE-2-(2-HYDROXYETHYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-CARBOXYLATE
SpectraBase Compound ID 1IKGFMHxdSM
InChI InChI=1S/C20H24N2O3/c1-3-12-11-22(8-9-23)16-10-14(12)18(20(24)25-2)17-13-6-4-5-7-15(13)21-19(16)17/h3-7,14,16,18,21,23H,8-11H2,1-2H3/b12-3+/t14?,16?,18-/m0/s1
InChIKey QOAJCANSDKZAMJ-DGHNETTISA-N
Mol Weight 340.42 g/mol
Molecular Formula C20H24N2O3
Exact Mass 340.178693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6prK5TMkcCz
Name METHYL-(1RS,5SR,6SR)-4-(E)-ETHYLIDENE-2-(2-HYDROXYETHYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-CARBOXYLATE
CAS Registry Number 119323-34-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24N2O3
InChI InChI=1S/C20H24N2O3/c1-3-12-11-22(8-9-23)16-10-14(12)18(20(24)25-2)17-13-6-4-5-7-15(13)21-19(16)17/h3-7,14,16,18,21,23H,8-11H2,1-2H3/b12-3+/t14?,16?,18-/m0/s1
InChIKey QOAJCANSDKZAMJ-DGHNETTISA-N
Literature Reference Author M.L.BENNASAR,M.ALVAREZ,R.LAVILLA,E.ZULAICA,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,55,1156(1990)
Literature Reference DOI 10.1021/jo00291a013
Molecular Weight 340.422 g/mol
Solvent CDCl3
Source File Reference UWED12543