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Ethyl 2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 8ecLZPwuEwY
InChI InChI=1S/C22H27NO4/c1-4-13-27-18-12-7-6-9-15(18)20-19(22(25)26-5-2)14(3)23-16-10-8-11-17(24)21(16)20/h6-7,9,12,20,23H,4-5,8,10-11,13H2,1-3H3
InChIKey SPWYVLPGBAENLZ-UHFFFAOYSA-N
Mol Weight 369.46 g/mol
Molecular Formula C22H27NO4
Exact Mass 369.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KioRoLvH3y8
Name Ethyl 2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 369.194008349 u
Formula C22H27NO4
InChI InChI=1S/C22H27NO4/c1-4-13-27-18-12-7-6-9-15(18)20-19(22(25)26-5-2)14(3)23-16-10-8-11-17(24)21(16)20/h6-7,9,12,20,23H,4-5,8,10-11,13H2,1-3H3
InChIKey SPWYVLPGBAENLZ-UHFFFAOYSA-N
Molecular Weight 369.461 g/mol
SMILES N1C(=C(C(C=2C(CCCC12)=O)C1=C(OCCC)C=CC=C1)C(=O)OCC)C