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METHYL-4-ALPHA-6-BETA-(METHOXYCARBONYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-2-ACETATE
SpectraBase Compound ID G6BUnTetgHX
InChI InChI=1S/C21H26N2O4/c1-4-12-10-23(11-17(24)26-2)16-9-14(12)19(21(25)27-3)18-13-7-5-6-8-15(13)22-20(16)18/h5-8,12,14,16,19,22H,4,9-11H2,1-3H3/t12-,14+,16+,19+/m1/s1
InChIKey DQZPHBKJZVPSAQ-AGLNLLDASA-N
Mol Weight 370.45 g/mol
Molecular Formula C21H26N2O4
Exact Mass 370.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4YpF8Altc9
Name METHYL-4-ALPHA-6-BETA-(METHOXYCARBONYL)-1,2,3,4,5,6-HEXAHYDRO-1,5-METHANOAZOCINO-[3,4-B]-INDOLE-2-ACETATE
Compound Number 61
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26N2O4
InChI InChI=1S/C21H26N2O4/c1-4-12-10-23(11-17(24)26-2)16-9-14(12)19(21(25)27-3)18-13-7-5-6-8-15(13)22-20(16)18/h5-8,12,14,16,19,22H,4,9-11H2,1-3H3/t12-,14+,16+,19+/m1/s1
InChIKey DQZPHBKJZVPSAQ-AGLNLLDASA-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 370.448 g/mol
Solvent CDCl3
Source File Reference UWGE1586