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5-ETHYLTHIO-5-HYDROXYBENZYL-4-METHOXYFURAN-2(5H)-ONE;ISOMER-#1
SpectraBase Compound ID 8iNtg8ebKKk
InChI InChI=1S/C14H16O4S/c1-3-19-14(11(17-2)9-12(15)18-14)13(16)10-7-5-4-6-8-10/h4-9,13,16H,3H2,1-2H3
InChIKey IEYSDYAWTGMPHY-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4v77UsAF8O
Name 5-ETHYLTHIO-5-HYDROXYBENZYL-4-METHOXYFURAN-2(5H)-ONE;ISOMER-#2
Compound Number 7B2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-3-19-14(11(17-2)9-12(15)18-14)13(16)10-7-5-4-6-8-10/h4-9,13,16H,3H2,1-2H3
InChIKey IEYSDYAWTGMPHY-UHFFFAOYSA-N
Literature Reference Author M.R.MARTIN,M.V.MARTIN,A.M.DEGUERENU,J.L.ORTEGO
Literature Reference Citation HETEROCYCLES,43,191(1996)
Literature Reference DOI 10.3987/COM-95-7258
Molecular Weight 280.339 g/mol
Solvent DMSO-D6
Source File Reference UWCS22312