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(5-S)-2',2',7-TRIMETHYL-5-(3-HYDROXY-4-METHOXYPHENYL)-2,3,3A,4,5,6-HEXAHYDROSPIRO-[1-BENZOTHIOPHENE-4,5'-[1.3]-DIOXANE]-4',6'-DIONE_1,1-DIOXIDE
SpectraBase Compound ID 1ifMAcMJYoJ
InChI InChI=1S/C21H24O8S/c1-11-9-14(12-5-6-16(27-4)15(22)10-12)21(13-7-8-30(25,26)17(11)13)18(23)28-20(2,3)29-19(21)24/h5-6,10,13-14,22H,7-9H2,1-4H3/t13?,14-/m0/s1
InChIKey UQDHHLJIHGPZKL-KZUDCZAMSA-N
Mol Weight 436.48 g/mol
Molecular Formula C21H24O8S
Exact Mass 436.119189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgMcJzg9hcC
Name (5-S)-2',2',7-TRIMETHYL-5-(3-HYDROXY-4-METHOXYPHENYL)-2,3,3A,4,5,6-HEXAHYDROSPIRO-[1-BENZOTHIOPHENE-4,5'-[1.3]-DIOXANE]-4',6'-DIONE_1,1-DIOXIDE
Compound Number XX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O8S
InChI InChI=1S/C21H24O8S/c1-11-9-14(12-5-6-16(27-4)15(22)10-12)21(13-7-8-30(25,26)17(11)13)18(23)28-20(2,3)29-19(21)24/h5-6,10,13-14,22H,7-9H2,1-4H3/t13?,14-/m0/s1
InChIKey UQDHHLJIHGPZKL-KZUDCZAMSA-N
Literature Reference Author G.N.ANDREEV,E.E.SHULTS,A.A.VOLKOV,M.M.SHAKIROV,I.Y.BAGRYANSK AYA,Y.V.GATILOV,G.A.
Literature Reference Citation RUSS.J.ORG.CHEM.,40,854(2004)
Literature Reference DOI 10.1023/B:RUJO.0000044549.81561.4f
Molecular Weight 436.477 g/mol
Solvent CDCl3
Source File Reference UWMZ16629