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3-quinolinecarboxylic acid, 4-(4-ethylphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7-phenyl-, 2-methoxyethyl ester
SpectraBase Compound ID HWEAwtbuPkU
InChI InChI=1S/C28H31NO4/c1-4-19-10-12-21(13-11-19)26-25(28(31)33-15-14-32-3)18(2)29-23-16-22(17-24(30)27(23)26)20-8-6-5-7-9-20/h5-13,22,26,29H,4,14-17H2,1-3H3
InChIKey CAQUCIBDGQDLEA-UHFFFAOYSA-N
Mol Weight 445.56 g/mol
Molecular Formula C28H31NO4
Exact Mass 445.225308 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3lnQ3sCrcZG
Name 3-quinolinecarboxylic acid, 4-(4-ethylphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7-phenyl-, 2-methoxyethyl 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/C28H31NO4/c1-4-19-10-12-21(13-11-19)26-25(28(31)33-15-14-32-3)18(2)29-23-16-22(17-24(30)27(23)26)20-8-6-5-7-9-20/h5-13,22,26,29H,4,14-17H2,1-3H3
InChIKey CAQUCIBDGQDLEA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_343
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/11258048