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1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-1,2,2,6-tetramethyl-3-thioxo-4(1H)-quinolinylidene)-, diethyl ester
SpectraBase Compound ID 2ohfDu2kscC
InChI InChI=1S/C22H25NO4S3/c1-7-26-19(24)16-17(20(25)27-8-2)30-21(29-16)15-13-11-12(3)9-10-14(13)23(6)22(4,5)18(15)28/h9-11H,7-8H2,1-6H3
InChIKey PSJMVPPPADLXFV-UHFFFAOYSA-N
Mol Weight 463.63 g/mol
Molecular Formula C22H25NO4S3
Exact Mass 463.094572 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HWM95eWvMlc
Name 1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-1,2,2,6-tetramethyl-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/C22H25NO4S3/c1-7-26-19(24)16-17(20(25)27-8-2)30-21(29-16)15-13-11-12(3)9-10-14(13)23(6)22(4,5)18(15)28/h9-11H,7-8H2,1-6H3
InChIKey PSJMVPPPADLXFV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4770
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/11328019