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N-PARA-CHLOROPHENYL-2,3-DIHYDRO-4-ETHOXYCARBONYL-8-CHLORO-CHROMANO-[2,3-B]-AZEPINE-6-ONE
SpectraBase Compound ID 9NbfyaONpre
InChI InChI=1S/C22H17Cl2NO4/c1-2-28-22(27)13-9-10-25(16-6-3-14(23)4-7-16)21-18(11-13)20(26)17-12-15(24)5-8-19(17)29-21/h3-8,11-12H,2,9-10H2,1H3
InChIKey TVYUOAMNRUFOOL-UHFFFAOYSA-N
Mol Weight 430.29 g/mol
Molecular Formula C22H17Cl2NO4
Exact Mass 429.053463 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDXvz176eoz
Name N-PARA-CHLOROPHENYL-2,3-DIHYDRO-4-ETHOXYCARBONYL-8-CHLORO-CHROMANO-[2,3-B]-AZEPINE-6-ONE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17Cl2NO4
InChI InChI=1S/C22H17Cl2NO4/c1-2-28-22(27)13-9-10-25(16-6-3-14(23)4-7-16)21-18(11-13)20(26)17-12-15(24)5-8-19(17)29-21/h3-8,11-12H,2,9-10H2,1H3
InChIKey TVYUOAMNRUFOOL-UHFFFAOYSA-N
Literature Reference Author K.KUMAR,R.KAPOOR,A.KAPUR,M.P.S.ISHAR
Literature Reference Citation ORG.LETTERS,2,2023(2000)
Literature Reference DOI 10.1021/ol0000713
Molecular Weight 430.287 g/mol
Solvent CDCl3
Source File Reference UWVN30319