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6-[2-(1,3-DIOXOLANYL)]-3-METHYL-8-METHOXYCARBONYL-2,3,4,5,6,7,8,9-OCTAHYDRO-1-H-AZECINO-[5.4-B]-INDOLE
SpectraBase Compound ID 3U7UWsmRvbO
InChI InChI=1S/C21H28N2O4/c1-22-11-9-15(20-26-13-14-27-20)7-8-19-17(10-12-22)16-5-3-4-6-18(16)23(19)21(24)25-2/h3-6,15,20H,7-14H2,1-2H3/t15-/m0/s1
InChIKey DQTJOWKNSDJKLI-HNNXBMFYSA-N
Mol Weight 372.47 g/mol
Molecular Formula C21H28N2O4
Exact Mass 372.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EL69QgWJU2n
Name 6-[2-(1,3-DIOXOLANYL)]-3-METHYL-8-METHOXYCARBONYL-2,3,4,5,6,7,8,9-OCTAHYDRO-1-H-AZECINO-[5.4-B]-INDOLE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O4
InChI InChI=1S/C21H28N2O4/c1-22-11-9-15(20-26-13-14-27-20)7-8-19-17(10-12-22)16-5-3-4-6-18(16)23(19)21(24)25-2/h3-6,15,20H,7-14H2,1-2H3/t15-/m0/s1
InChIKey DQTJOWKNSDJKLI-HNNXBMFYSA-N
Literature Reference Author J.BONJOCH,J.C.FERNANDEZ,N.VALLS
Literature Reference Citation J.ORG.CHEM.,63,7338(1998)
Literature Reference DOI 10.1021/jo980909o
Molecular Weight 372.464 g/mol
Sample ID 27354
Solvent CDCl3