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5-ETHOXYCARBONYLMETHYL-4A-(METHYLTHIO)-CARBONYL-1-HYDROXY-6-METHYL-2,4A,5,8-TETRAHYDRONAPHTHALEN-2-ONE
SpectraBase Compound ID 4vDFbACEJky
InChI InChI=1S/C17H20O5S/c1-4-22-14(19)9-12-10(2)5-6-11-15(20)13(18)7-8-17(11,12)16(21)23-3/h5,7-8,12,20H,4,6,9H2,1-3H3
InChIKey FAGLDABOCLWKAN-UHFFFAOYSA-N
Mol Weight 336.4 g/mol
Molecular Formula C17H20O5S
Exact Mass 336.103145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FoOFHYIuX9W
Name 5-ETHOXYCARBONYLMETHYL-4A-(METHYLTHIO)-CARBONYL-1-HYDROXY-6-METHYL-2,4A,5,8-TETRAHYDRONAPHTHALEN-2-ONE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O5S
InChI InChI=1S/C17H20O5S/c1-4-22-14(19)9-12-10(2)5-6-11-15(20)13(18)7-8-17(11,12)16(21)23-3/h5,7-8,12,20H,4,6,9H2,1-3H3
InChIKey FAGLDABOCLWKAN-UHFFFAOYSA-N
Literature Reference Author R.CARLINI,C.L.FANG,D.HERRINGTON,K.HIGGS,R.RODRIGO,N.TAYLOR
Literature Reference Citation AUSTR.J.CHEM.,50,271(1997)
Literature Reference DOI 10.1071/C96099
Molecular Weight 336.403 g/mol
Solvent CDCl3
Source File Reference UWCS15763