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2-Phenyl-thiopyran-4-one-2,3-butanediole-ketale
SpectraBase Compound ID DZ9EOpjy0R
InChI InChI=1S/C15H20O2S/c1-11-12(2)17-15(16-11)8-9-18-14(10-15)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3
InChIKey WUIMQFKRTIYVEV-UHFFFAOYSA-N
Mol Weight 264.38 g/mol
Molecular Formula C15H20O2S
Exact Mass 264.118401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BYodNrLHUj
Name 2-Phenyl-thiopyran-4-one-2,3-butanediole-ketale
CAS Registry Number 71772-89-9
Comments ENANTIOMER 2 PPM VALUES MIGHT BE INTERCHANGED BETWEEN BOTH ENANTIOMERS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H20O2S
InChI InChI=1S/C15H20O2S/c1-11-12(2)17-15(16-11)8-9-18-14(10-15)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3
InChIKey WUIMQFKRTIYVEV-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference J. Davies, J.B. Jones, J. Am. Chem. Soc. 101, 5405 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3