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METHYL_3-(E)-ETHYLIDENE-5-(TRIFLUOROACETYL)-1,2,3,4,5,6-HEXAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-1-BETA-CARBOXYLATE

View entire compound with spectra: 1 NMR

METHYL_3-(E)-ETHYLIDENE-5-(TRIFLUOROACETYL)-1,2,3,4,5,6-HEXAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-1-BETA-CARBOXYLATE
SpectraBase Compound ID 3zzmODpoSkR
InChI InChI=1S/C20H19F3N2O3/c1-3-11-10-24(19(27)20(21,22)23)15-9-13(11)17(18(26)28-2)25-14-7-5-4-6-12(14)8-16(15)25/h3-8,13,15,17H,9-10H2,1-2H3/b11-3+/t13-,15-,17+/m0/s1
InChIKey VDFNEYHVMFMVCT-WEICSHPUSA-N
Mol Weight 392.38 g/mol
Molecular Formula C20H19F3N2O3
Exact Mass 392.134777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kwq2o4bXgpt
Name METHYL_3-(E)-ETHYLIDENE-5-(TRIFLUOROACETYL)-1,2,3,4,5,6-HEXAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-1-BETA-CARBOXYLATE
Compound Number 37A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19F3N2O3
InChI InChI=1S/C20H19F3N2O3/c1-3-11-10-24(19(27)20(21,22)23)15-9-13(11)17(18(26)28-2)25-14-7-5-4-6-12(14)8-16(15)25/h3-8,13,15,17H,9-10H2,1-2H3/b11-3+/t13-,15-,17+/m0/s1
InChIKey VDFNEYHVMFMVCT-WEICSHPUSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,J.M.JIMENEZ,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,58,7756(1993)
Literature Reference DOI 10.1021/jo00079a021
Molecular Weight 392.378 g/mol
Solvent CDCl3
Source File Reference UWMZ2035