dimethyl 2-(1-[(2E)-2-butenoyl]-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate

SpectraBase Compound ID	8XAdlnl9X40
InChI	InChI=1S/C22H21NO5S3/c1-6-9-14(24)23-13-11-8-7-10-12(13)15(18(29)22(23,2)3)21-30-16(19(25)27-4)17(31-21)20(26)28-5/h6-11H,1-5H3/b9-6+
InChIKey	LHVWZLOQQJPOEM-RMKNXTFCSA-N Google Search
Mol Weight	475.59 g/mol
Molecular Formula	C22H21NO5S3
Exact Mass	475.058186 g/mol

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SpectraBase Spectrum ID	7hiHkSErCq9
Name	dimethyl 2-(1-[(2E)-2-butenoyl]-2,2-dimethyl-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/C22H21NO5S3/c1-6-9-14(24)23-13-11-8-7-10-12(13)15(18(29)22(23,2)3)21-30-16(19(25)27-4)17(31-21)20(26)28-5/h6-11H,1-5H3/b9-6+
InChIKey	LHVWZLOQQJPOEM-RMKNXTFCSA-N
NMR Offset	15.4978
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_6476
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/8185264; UBI_ID: UBI-006478
Synonyms	dimethyl 2-(1-[2-butenoyl]-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
Temperature	315 °C