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2-Hydroxy-4,5-dihydro-3-benzothiepin-1(2H)-one

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2-Hydroxy-4,5-dihydro-3-benzothiepin-1(2H)-one
SpectraBase Compound ID 4ELc06cTg4C
InChI InChI=1S/C10H10O2S/c11-9-8-4-2-1-3-7(8)5-6-13-10(9)12/h1-4,10,12H,5-6H2
InChIKey RHLCJCOCOIYYAB-UHFFFAOYSA-N
Mol Weight 194.25 g/mol
Molecular Formula C10H10O2S
Exact Mass 194.040151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BbVZKjAGyeg
Name 2-Hydroxy-4,5-dihydro-3-benzothiepin-1(2H)-one
CAS Registry Number 83501-50-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10O2S
InChI InChI=1S/C10H10O2S/c11-9-8-4-2-1-3-7(8)5-6-13-10(9)12/h1-4,10,12H,5-6H2
InChIKey RHLCJCOCOIYYAB-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference H. Boehme, P. Sutoyo, Liebigs Ann. Chem. 1643 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3