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3-quinolinecarboxylic acid, 4-(2-bromophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, cyclopentyl ester
SpectraBase Compound ID JKORflPK9Ih
InChI InChI=1S/C22H24BrNO3/c1-13-19(22(26)27-14-7-2-3-8-14)20(15-9-4-5-10-16(15)23)21-17(24-13)11-6-12-18(21)25/h4-5,9-10,14,20,24H,2-3,6-8,11-12H2,1H3
InChIKey KETZDJSADRQYOD-UHFFFAOYSA-N
Mol Weight 430.34 g/mol
Molecular Formula C22H24BrNO3
Exact Mass 429.093957 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GKJS1vXnT6p
Name 3-quinolinecarboxylic acid, 4-(2-bromophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, cyclopentyl 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/C22H24BrNO3/c1-13-19(22(26)27-14-7-2-3-8-14)20(15-9-4-5-10-16(15)23)21-17(24-13)11-6-12-18(21)25/h4-5,9-10,14,20,24H,2-3,6-8,11-12H2,1H3
InChIKey KETZDJSADRQYOD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_504
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/11258309