5-[(BENZOTHIAZOL-2-YL)-(ETHOXYCARBONYL)-METHYLENE]-3-METHYL-4,5-DIHYDRO-1,2,3-THIADIAZOL-3-IUM-4-IDE

SpectraBase Compound ID	89ErYUr9bqs
InChI	InChI=1S/C14H13N3O2S2/c1-3-19-14(18)12(11-8-17(2)16-21-11)13-15-9-6-4-5-7-10(9)20-13/h4-8H,3H2,1-2H3/b12-11+
InChIKey	HCXMKCAPDCXGTK-VAWYXSNFSA-N Google Search
Mol Weight	319.4 g/mol
Molecular Formula	C14H13N3O2S2
Exact Mass	319.044919 g/mol

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SpectraBase Spectrum ID	LfKwaHXby8m
Name	5-[(BENZOTHIAZOL-2-YL)-(ETHOXYCARBONYL)-METHYLENE]-3-METHYL-4,5-DIHYDRO-1,2,3-THIADIAZOL-3-IUM-4-IDE
Compound Number	15
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C14H13N3O2S2/c1-3-19-14(18)12(11-8-17(2)16-21-11)13-15-9-6-4-5-7-10(9)20-13/h4-8H,3H2,1-2H3/b12-11+
InChIKey	HCXMKCAPDCXGTK-VAWYXSNFSA-N
Literature Reference	G.LABBE,L.BASTIN,W.DEHAEN,S.TOPPET,P.DELBEKE,D.VLIEGHE,L.VANMEERVELT J.CHEM.SOC.PERKIN-1,2545(1994)
Solvent	Dimethyl sulfoxide-d6