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Tetrahydro-4H-thiopyran-4-one
SpectraBase Compound ID F6nlj3Geobl
InChI InChI=1S/C5H8OS/c6-5-1-3-7-4-2-5/h1-4H2
InChIKey OVRJVKCZJCNSOW-UHFFFAOYSA-N
Mol Weight 116.18 g/mol
Molecular Formula C5H8OS
Exact Mass 116.029586 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GnsALnEhMPA
Name TETRAHYDROTHIOPYRAN-4-ON
CAS Registry Number 1072-72-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H8OS
InChI InChI=1S/C5H8OS/c6-5-1-3-7-4-2-5/h1-4H2
InChIKey OVRJVKCZJCNSOW-UHFFFAOYSA-N
Literature Reference Author J.A.HIRSCH,E.HAVINGA
Literature Reference Citation J.ORG.CHEM.,41,455(1976)
Literature Reference DOI 10.1021/jo00865a008
Molecular Weight 116.178 g/mol
Solvent CDCl3
Source File Reference UNIW10853