For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(2-methoxyphenyl)-2-methyl-5-oxo-, 2-(ethylthio)ethyl ester
SpectraBase Compound ID 8d9Iroklt0I
InChI InChI=1S/C22H27NO4S/c1-4-28-13-12-27-22(25)19-14(2)23-16-9-7-10-17(24)21(16)20(19)15-8-5-6-11-18(15)26-3/h5-6,8,11,20,23H,4,7,9-10,12-13H2,1-3H3
InChIKey WBTYEFXDTNTMAF-UHFFFAOYSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EKGpcTpfpsD
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(2-methoxyphenyl)-2-methyl-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/C22H27NO4S/c1-4-28-13-12-27-22(25)19-14(2)23-16-9-7-10-17(24)21(16)20(19)15-8-5-6-11-18(15)26-3/h5-6,8,11,20,23H,4,7,9-10,12-13H2,1-3H3
InChIKey WBTYEFXDTNTMAF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_367
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/11258084