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Benzothiopyran-2-one
SpectraBase Compound ID CKMbgw1nkzg
InChI InChI=1S/C9H6OS/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
InChIKey MDYPJPPXVOPUNX-UHFFFAOYSA-N
Mol Weight 162.21 g/mol
Molecular Formula C9H6OS
Exact Mass 162.013936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sZ7RSsxI4e
Name Benzothiopyran-2-one
CAS Registry Number 1075-14-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6OS
InChI InChI=1S/C9H6OS/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
InChIKey MDYPJPPXVOPUNX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference I.W. Still, N. Plavac, D.M. McKinnon, Can. J. Chem. 54, 280 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3