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5-(2,2-DIMETHYLPROPIONYL)-7-ETHOXY-3,4,5,6-TETRAHYDRO-1H-AZEPINO-[5,4,3-CD]-INDOLE-2-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 8MTS9J9YYEa
InChI InChI=1S/C21H28N2O4/c1-6-26-16-9-8-15-17-13(18(22-15)19(24)27-7-2)10-11-23(12-14(16)17)20(25)21(3,4)5/h8-9,22H,6-7,10-12H2,1-5H3
InChIKey RPRLMGJSARBMJC-UHFFFAOYSA-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 TgCKbXt6TH
Name 5-(2,2-DIMETHYLPROPIONYL)-7-ETHOXY-3,4,5,6-TETRAHYDRO-1H-AZEPINO-[5,4,3-CD]-INDOLE-2-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 10K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O4
InChI InChI=1S/C21H28N2O4/c1-6-26-16-9-8-15-17-13(18(22-15)19(24)27-7-2)10-11-23(12-14(16)17)20(25)21(3,4)5/h8-9,22H,6-7,10-12H2,1-5H3
InChIKey RPRLMGJSARBMJC-UHFFFAOYSA-N
Literature Reference Author L.NOVAK,M.HANANIA,P.KOVACS,J.ROHALY,P.KOLONITS,C.SZANTAY
Literature Reference Citation HETEROCYCLES,45,2331(1997)
Literature Reference DOI 10.3987/COM-97-7918
Molecular Weight 372.464 g/mol
Solvent CDCl3
Source File Reference UWCP4725