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dimethyl 2-(6-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate

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dimethyl 2-(6-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
SpectraBase Compound ID BFS6y5qCPsB
InChI InChI=1S/C22H20F3NO6S3/c1-6-32-10-7-8-12-11(9-10)13(16(33)21(2,3)26(12)20(29)22(23,24)25)19-34-14(17(27)30-4)15(35-19)18(28)31-5/h7-9H,6H2,1-5H3
InChIKey HOEOQXKDGICWOO-UHFFFAOYSA-N
Mol Weight 547.58 g/mol
Molecular Formula C22H20F3NO6S3
Exact Mass 547.040485 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LJoGp6ImPbC
Name dimethyl 2-(6-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
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/C22H20F3NO6S3/c1-6-32-10-7-8-12-11(9-10)13(16(33)21(2,3)26(12)20(29)22(23,24)25)19-34-14(17(27)30-4)15(35-19)18(28)31-5/h7-9H,6H2,1-5H3
InChIKey HOEOQXKDGICWOO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11645
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: 803013; Labnumber: VOR7-0283; VK_ID: VK-011650
Temperature 315 °C