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6-METHYL-THIOCHROMAN-4-ON-1-OXID

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6-METHYL-THIOCHROMAN-4-ON-1-OXID
SpectraBase Compound ID 52AjBasBz1n
InChI InChI=1S/C10H10O2S/c1-7-2-3-10-8(6-7)9(11)4-5-13(10)12/h2-3,6H,4-5H2,1H3
InChIKey SNEBBWNOTIREQE-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 IvJsqPmdhYz
Name 6-Methyl-thiochromanone 1-oxide
CAS Registry Number 42244-87-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10O2S
InChI InChI=1S/C10H10O2S/c1-7-2-3-10-8(6-7)9(11)4-5-13(10)12/h2-3,6H,4-5H2,1H3
InChIKey SNEBBWNOTIREQE-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.S. Chauhan, I.W. Still, Can. J. Chem. 53, 2880 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3