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(2R*,2'S*,3S*)-3,5-DIMETHYL-2-[1-(PHENYLTHIO)-PROPYL]-2,3-DIHYDRO-4H-PYRAN-4-ONE
SpectraBase Compound ID E0jLkPkR7g0
InChI InChI=1S/C16H20O2S/c1-4-14(19-13-8-6-5-7-9-13)16-12(3)15(17)11(2)10-18-16/h5-10,12,14,16H,4H2,1-3H3/t12-,14-,16-/m0/s1
InChIKey SILPGVLVJJPWNS-NOLJZWGESA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FzUL4EUNxgO
Name (2R*,2'S*,3S*)-3,5-DIMETHYL-2-[1-(PHENYLTHIO)-PROPYL]-2,3-DIHYDRO-4H-PYRAN-4-ONE
CAS Registry Number 140928-83-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-4-14(19-13-8-6-5-7-9-13)16-12(3)15(17)11(2)10-18-16/h5-10,12,14,16H,4H2,1-3H3/t12-,14-,16-/m0/s1
InChIKey SILPGVLVJJPWNS-NOLJZWGESA-N
Literature Reference Author R.ANNUNZIATA,M.CINQUINI,F.COZZI,P.G.COZZI,L.RAIMONDI
Literature Reference Citation J.ORG.CHEM.,57,3605(1992)
Literature Reference DOI 10.1021/jo00039a019
Molecular Weight 276.394 g/mol
Solvent CDCl3
Source File Reference UWCS720