8-METHYL-2,3-BENZO-5-OXA-[10]-ALPHA-CYCLOTHIEN-1,4-DIONE

SpectraBase Compound ID	7jadDSbaSQ7
InChI	InChI=1S/C18H18O3S/c1-12-6-7-13-8-9-16(22-13)17(19)14-4-2-3-5-15(14)18(20)21-11-10-12/h2-5,8-9,12H,6-7,10-11H2,1H3
InChIKey	MPXPRCKGGNQWFO-UHFFFAOYSA-N Google Search
Mol Weight	314.4 g/mol
Molecular Formula	C18H18O3S
Exact Mass	314.097666 g/mol

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SpectraBase Spectrum ID	CBNN8NuswoD
Name	8-METHYL-2,3-BENZO-5-OXA-[10]-ALPHA-CYCLOTHIEN-1,4-DIONE
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C18H18O3S
InChI	InChI=1S/C18H18O3S/c1-12-6-7-13-8-9-16(22-13)17(19)14-4-2-3-5-15(14)18(20)21-11-10-12/h2-5,8-9,12H,6-7,10-11H2,1H3
InChIKey	MPXPRCKGGNQWFO-UHFFFAOYSA-N
Instrument Name	Varian XL-100
Literature Reference	R.DURDYEV, A.V.KESSENIKH, L.V.SHMELEV, F.D.ALASHEV (1988)Teor.Exper.Khim.(Russ. Lang.): v.24, N3, 375-380.
NMR Standard	TMS
Origin	Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent	CDCl3