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ethyl (2Z)-2-(1-isobutyryl-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate
SpectraBase Compound ID wyGKzf2RLp
InChI InChI=1S/C27H27NO3S3/c1-6-31-25(30)22-21(17-12-8-7-9-13-17)33-26(34-22)20-18-14-10-11-15-19(18)28(24(29)16(2)3)27(4,5)23(20)32/h7-16H,6H2,1-5H3/b26-20-
InChIKey XZBVSMXXXCBSTQ-QOMWVZHYSA-N
Mol Weight 509.7 g/mol
Molecular Formula C27H27NO3S3
Exact Mass 509.115307 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Lh71O6MTUE
Name ethyl (2Z)-2-(1-isobutyryl-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate
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/C27H27NO3S3/c1-6-31-25(30)22-21(17-12-8-7-9-13-17)33-26(34-22)20-18-14-10-11-15-19(18)28(24(29)16(2)3)27(4,5)23(20)32/h7-16H,6H2,1-5H3/b26-20-
InChIKey XZBVSMXXXCBSTQ-QOMWVZHYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13306
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: 102146; Labnumber: VOR2-2166; VK_ID: VK-013311
Synonyms ethyl 2-(1-isobutyryl-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate
Temperature 315 °C