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4-(PARA-FLUOROBENZOYL)-5-HYDROXY-1,3-BENZOXATHIOL-2-ONE
SpectraBase Compound ID GIALAVqwVz5
InChI InChI=1S/C14H7FO4S/c15-8-3-1-7(2-4-8)12(17)11-9(16)5-6-10-13(11)20-14(18)19-10/h1-6,16H
InChIKey ZWPZSAJWSOEQOX-UHFFFAOYSA-N
Mol Weight 290.26 g/mol
Molecular Formula C14H7FO4S
Exact Mass 290.004908 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SLz0tSxJAq
Name 4-(4-Fluoro-benzoyl)-5-hydroxy-1,3-benzoxathiol-2-one
CAS Registry Number 112450-19-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H7FO4S
InChI InChI=1S/C14H7FO4S/c15-8-3-1-7(2-4-8)12(17)11-9(16)5-6-10-13(11)20-14(18)19-10/h1-6,16H
InChIKey ZWPZSAJWSOEQOX-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference R. Al-Hamdany, J.M. Al-Rawi, B.A.Ahmed, J. Prakt. Chem. 329, 337 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3