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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-, cyclopentyl ester
SpectraBase Compound ID Fsa7c9m0ccz
InChI InChI=1S/C25H31NO6/c1-14-22(25(28)32-15-8-5-6-9-15)23(24-17(26-14)10-7-11-18(24)27)16-12-20(30-3)21(31-4)13-19(16)29-2/h12-13,15,23,26H,5-11H2,1-4H3
InChIKey AORUGPLBIQBNIR-UHFFFAOYSA-N
Mol Weight 441.52 g/mol
Molecular Formula C25H31NO6
Exact Mass 441.215138 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9BHZnbJaF6e
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-, 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/C25H31NO6/c1-14-22(25(28)32-15-8-5-6-9-15)23(24-17(26-14)10-7-11-18(24)27)16-12-20(30-3)21(31-4)13-19(16)29-2/h12-13,15,23,26H,5-11H2,1-4H3
InChIKey AORUGPLBIQBNIR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7271
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/10328737