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METHYL-2-(CHLOROACETYL)-4-ALPHA-ETHYL-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
SpectraBase Compound ID A0KtjPavvAV
InChI InChI=1S/C20H23ClN2O3/c1-3-11-10-23(16(24)9-21)15-8-13(11)18(20(25)26-2)17-12-6-4-5-7-14(12)22-19(15)17/h4-7,11,13,15,18,22H,3,8-10H2,1-2H3/t11-,13+,15+,18+/m1/s1
InChIKey JXZWXIUMUNKISZ-YMXNGHFFSA-N
Mol Weight 374.87 g/mol
Molecular Formula C20H23ClN2O3
Exact Mass 374.13972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTxp1x2jlQj
Name METHYL-2-(CHLOROACETYL)-4-ALPHA-ETHYL-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-6-BETA-CARBOXYLATE
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H23ClN2O3
InChI InChI=1S/C20H23ClN2O3/c1-3-11-10-23(16(24)9-21)15-8-13(11)18(20(25)26-2)17-12-6-4-5-7-14(12)22-19(15)17/h4-7,11,13,15,18,22H,3,8-10H2,1-2H3/t11-,13+,15+,18+/m1/s1
InChIKey JXZWXIUMUNKISZ-YMXNGHFFSA-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 374.867 g/mol
Solvent CDCl3
Source File Reference UWGE1573