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[(3-butyl-8-methoxy-2-methyl-4-quinolinyl)sulfanyl]acetic acid
SpectraBase Compound ID 9DxUwl5WKf6
InChI InChI=1S/C17H21NO3S/c1-4-5-7-12-11(2)18-16-13(8-6-9-14(16)21-3)17(12)22-10-15(19)20/h6,8-9H,4-5,7,10H2,1-3H3,(H,19,20)
InChIKey HFTGYICHDHHCTL-UHFFFAOYSA-N
Mol Weight 319.42 g/mol
Molecular Formula C17H21NO3S
Exact Mass 319.124215 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AP1nLDtNGcl
Name [(3-butyl-8-methoxy-2-methyl-4-quinolinyl)sulfanyl]acetic acid
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/C17H21NO3S/c1-4-5-7-12-11(2)18-16-13(8-6-9-14(16)21-3)17(12)22-10-15(19)20/h6,8-9H,4-5,7,10H2,1-3H3,(H,19,20)
InChIKey HFTGYICHDHHCTL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11995
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: 100662; Labnumber: ARDU4-532; VK_ID: VK-012000
Temperature 308 °C