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Benzothiopyran-2-one

View entire compound with spectra: 4 NMR, and 3 MS (GC)

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 77hxCbPDVtH
Name BENZOTHIOPYRAN-2-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author I.W.J.STILL,N.PLAVAC,D.M.MCKINNON,M.S.CHAUHAN
Literature Reference Citation CAN.J.CHEM.,54,280(1976)
Literature Reference DOI 10.1139/v76-042
Molecular Weight 162.206 g/mol
Solvent CDCl3
Source File Reference UWED2875