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(2S*,2'S*)-2-[1-(METHYLTHIO)-PROPYL]-2,3-DIHYDRO-4H-PYRAN-4-ONE
SpectraBase Compound ID KRSXnIvsma9
InChI InChI=1S/C9H14O2S/c1-3-9(12-2)8-6-7(10)4-5-11-8/h4-5,8-9H,3,6H2,1-2H3/t8-,9-/m1/s1
InChIKey UEAWOXALZLDYEX-RKDXNWHRSA-N
Mol Weight 186.27 g/mol
Molecular Formula C9H14O2S
Exact Mass 186.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E5jRWRQhl84
Name (2S*,2'S*)-2-[1-(METHYLTHIO)-PROPYL]-2,3-DIHYDRO-4H-PYRAN-4-ONE
CAS Registry Number 140928-72-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O2S
InChI InChI=1S/C9H14O2S/c1-3-9(12-2)8-6-7(10)4-5-11-8/h4-5,8-9H,3,6H2,1-2H3/t8-,9-/m1/s1
InChIKey UEAWOXALZLDYEX-RKDXNWHRSA-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 186.269 g/mol
Solvent CDCl3
Source File Reference UWCS710