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

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dimethyl 2-(6-methoxy-2,2-dimethyl-1-(3-methylbutanoyl)-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
SpectraBase Compound ID EDHbLCp3P6U
InChI InChI=1S/C24H27NO6S3/c1-12(2)10-16(26)25-15-9-8-13(29-5)11-14(15)17(20(32)24(25,3)4)23-33-18(21(27)30-6)19(34-23)22(28)31-7/h8-9,11-12H,10H2,1-7H3
InChIKey IJXYETSQODXPSS-UHFFFAOYSA-N
Mol Weight 521.66 g/mol
Molecular Formula C24H27NO6S3
Exact Mass 521.100051 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BMSU5NIIYx2
Name dimethyl 2-(6-methoxy-2,2-dimethyl-1-(3-methylbutanoyl)-3-thioxo-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/C24H27NO6S3/c1-12(2)10-16(26)25-15-9-8-13(29-5)11-14(15)17(20(32)24(25,3)4)23-33-18(21(27)30-6)19(34-23)22(28)31-7/h8-9,11-12H,10H2,1-7H3
InChIKey IJXYETSQODXPSS-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6042
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: UZI/8177170; UBI_ID: UBI-006044
Temperature 313 °C