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1,3-dithiole-4,5-dicarboxylic acid, 2-(1-benzoyl-2,3-dihydro-2,2,6-trimethyl-3-thioxo-4(1H)-quinolinylidene)-, dimethyl ester

View entire compound with spectra: 1 NMR

1,3-dithiole-4,5-dicarboxylic acid, 2-(1-benzoyl-2,3-dihydro-2,2,6-trimethyl-3-thioxo-4(1H)-quinolinylidene)-, dimethyl ester
SpectraBase Compound ID 3vxBHUPjAQf
InChI InChI=1S/C26H23NO5S3/c1-14-11-12-17-16(13-14)18(25-34-19(23(29)31-4)20(35-25)24(30)32-5)21(33)26(2,3)27(17)22(28)15-9-7-6-8-10-15/h6-13H,1-5H3
InChIKey OXYRIIRRDFNROV-UHFFFAOYSA-N
Mol Weight 525.65 g/mol
Molecular Formula C26H23NO5S3
Exact Mass 525.073836 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LHRKLlUxOQo
Name 1,3-dithiole-4,5-dicarboxylic acid, 2-(1-benzoyl-2,3-dihydro-2,2,6-trimethyl-3-thioxo-4(1H)-quinolinylidene)-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 525.073836362 u
Formula C26H23NO5S3
InChI InChI=1S/C26H23NO5S3/c1-14-11-12-17-16(13-14)18(25-34-19(23(29)31-4)20(35-25)24(30)32-5)21(33)26(2,3)27(17)22(28)15-9-7-6-8-10-15/h6-13H,1-5H3
InChIKey OXYRIIRRDFNROV-UHFFFAOYSA-N
Molecular Weight 525.652 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3009
Solvent DMSO-d6
Source Vendor ID: NMR/9248764; Lab Info: *1094979*; Lab Number: BAS 1094979
Temperature 29.85 °C