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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-4-(5-methyl-2-furanyl)-5-oxo-, 2-(ethylthio)ethyl ester

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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-4-(5-methyl-2-furanyl)-5-oxo-, 2-(ethylthio)ethyl ester
SpectraBase Compound ID 4xiwWgffZ4w
InChI InChI=1S/C22H29NO4S/c1-6-28-10-9-26-21(25)18-14(3)23-15-11-22(4,5)12-16(24)19(15)20(18)17-8-7-13(2)27-17/h7-8,20,23H,6,9-12H2,1-5H3
InChIKey SWRFQWIGVHMEBX-UHFFFAOYSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Kg3PcC06zQ
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-4-(5-methyl-2-furanyl)-5-oxo-, 2-(ethylthio)ethyl 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/C22H29NO4S/c1-6-28-10-9-26-21(25)18-14(3)23-15-11-22(4,5)12-16(24)19(15)20(18)17-8-7-13(2)27-17/h7-8,20,23H,6,9-12H2,1-5H3
InChIKey SWRFQWIGVHMEBX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_5928
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/10220409; Labnumber: SAS-tst3403
Temperature 303 °C