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1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-2,2,7-trimethyl-3-thioxo-4(1H)-quinolinylidene)-, diethyl ester
SpectraBase Compound ID HREAiZO8cre
InChI InChI=1S/C21H23NO4S3/c1-6-25-18(23)15-16(19(24)26-7-2)29-20(28-15)14-12-9-8-11(3)10-13(12)22-21(4,5)17(14)27/h8-10,22H,6-7H2,1-5H3
InChIKey DHKRXLFHKUMNOX-UHFFFAOYSA-N
Mol Weight 449.6 g/mol
Molecular Formula C21H23NO4S3
Exact Mass 449.078922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L3puf3qXzMa
Name 1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-2,2,7-trimethyl-3-thioxo-4(1H)-quinolinylidene)-, diethyl 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/C21H23NO4S3/c1-6-25-18(23)15-16(19(24)26-7-2)29-20(28-15)14-12-9-8-11(3)10-13(12)22-21(4,5)17(14)27/h8-10,22H,6-7H2,1-5H3
InChIKey DHKRXLFHKUMNOX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_5069
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/12218578