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diethyl 2-(1-isobutyryl-2,2,6,8-tetramethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
SpectraBase Compound ID 2Fnwj12b7Fj
InChI InChI=1S/C26H31NO5S3/c1-9-31-23(29)19-20(24(30)32-10-2)35-25(34-19)17-16-12-14(5)11-15(6)18(16)27(22(28)13(3)4)26(7,8)21(17)33/h11-13H,9-10H2,1-8H3
InChIKey GRHXWBRVJHCJAI-UHFFFAOYSA-N
Mol Weight 533.72 g/mol
Molecular Formula C26H31NO5S3
Exact Mass 533.136437 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Idbhb56cBBv
Name diethyl 2-(1-isobutyryl-2,2,6,8-tetramethyl-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/C26H31NO5S3/c1-9-31-23(29)19-20(24(30)32-10-2)35-25(34-19)17-16-12-14(5)11-15(6)18(16)27(22(28)13(3)4)26(7,8)21(17)33/h11-13H,9-10H2,1-8H3
InChIKey GRHXWBRVJHCJAI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_14047
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: 201033; Labnumber: VGU-06013; VK_ID: VK-014052
Temperature 308 °C