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3-quinolinecarboxylic acid, 4-(2-chlorophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, butyl ester
SpectraBase Compound ID 1iRHV1ZctfU
InChI InChI=1S/C21H24ClNO3/c1-3-4-12-26-21(25)18-13(2)23-16-10-7-11-17(24)20(16)19(18)14-8-5-6-9-15(14)22/h5-6,8-9,19,23H,3-4,7,10-12H2,1-2H3
InChIKey COHNVGGRUGXQGK-UHFFFAOYSA-N
Mol Weight 373.88 g/mol
Molecular Formula C21H24ClNO3
Exact Mass 373.144471 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JH2a2HTzrIz
Name 3-quinolinecarboxylic acid, 4-(2-chlorophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, butyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H24ClNO3/c1-3-4-12-26-21(25)18-13(2)23-16-10-7-11-17(24)20(16)19(18)14-8-5-6-9-15(14)22/h5-6,8-9,19,23H,3-4,7,10-12H2,1-2H3
InChIKey COHNVGGRUGXQGK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_330
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11258031