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3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, phenylmethyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, phenylmethyl ester
SpectraBase Compound ID 4E4QM8tvK19
InChI InChI=1S/C25H24BrNO5/c1-14-21(25(30)32-13-15-7-4-3-5-8-15)22(23-18(27-14)9-6-10-19(23)28)16-11-17(26)24(29)20(12-16)31-2/h3-5,7-8,11-12,22,27,29H,6,9-10,13H2,1-2H3
InChIKey KEBUZUGVUCPRMP-UHFFFAOYSA-N
Mol Weight 498.37 g/mol
Molecular Formula C25H24BrNO5
Exact Mass 497.083786 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2hG1QSoUe8K
Name 3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, phenylmethyl 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/C25H24BrNO5/c1-14-21(25(30)32-13-15-7-4-3-5-8-15)22(23-18(27-14)9-6-10-19(23)28)16-11-17(26)24(29)20(12-16)31-2/h3-5,7-8,11-12,22,27,29H,6,9-10,13H2,1-2H3
InChIKey KEBUZUGVUCPRMP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_233
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/11249995