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

View entire compound with spectra: 1 NMR

1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-2,2,6-trimethyl-1-(2-methyl-1-oxopropyl)-3-thioxo-4(1H)-quinolinylidene)-, dimethyl ester
SpectraBase Compound ID JcRheqcr6nN
InChI InChI=1S/C23H25NO5S3/c1-11(2)19(25)24-14-9-8-12(3)10-13(14)15(18(30)23(24,4)5)22-31-16(20(26)28-6)17(32-22)21(27)29-7/h8-11H,1-7H3
InChIKey JXKAKNTVLFDBSL-UHFFFAOYSA-N
Mol Weight 491.64 g/mol
Molecular Formula C23H25NO5S3
Exact Mass 491.089486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CnhOMD5h2oZ
Name 1,3-dithiole-4,5-dicarboxylic acid, 2-(2,3-dihydro-2,2,6-trimethyl-1-(2-methyl-1-oxopropyl)-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 491.089486426 u
Formula C23H25NO5S3
InChI InChI=1S/C23H25NO5S3/c1-11(2)19(25)24-14-9-8-12(3)10-13(14)15(18(30)23(24,4)5)22-31-16(20(26)28-6)17(32-22)21(27)29-7/h8-11H,1-7H3
InChIKey JXKAKNTVLFDBSL-UHFFFAOYSA-N
Molecular Weight 491.635 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5645
Solvent DMSO-d6
Source Vendor ID: NMR/9235180; Lab Info: LP; Lab Number: LP-1500910