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1-(2',4'-DIHYDROXY-5'-METHYL-3'-METHYLSULFANYLMETHYLPHENYL)-ETHANONE
SpectraBase Compound ID CQ6uw3TkuSe
InChI InChI=1S/C11H14O3S/c1-6-4-8(7(2)12)11(14)9(5-15-3)10(6)13/h4,13-14H,5H2,1-3H3
InChIKey BEWHJXXDZIMOAV-UHFFFAOYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C11H14O3S
Exact Mass 226.066365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 69NSgROdnnE
Name 1-(2',4'-DIHYDROXY-5'-METHYL-3'-METHYLSULFANYLMETHYLPHENYL)-ETHANONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14O3S
InChI InChI=1S/C11H14O3S/c1-6-4-8(7(2)12)11(14)9(5-15-3)10(6)13/h4,13-14H,5H2,1-3H3
InChIKey BEWHJXXDZIMOAV-UHFFFAOYSA-N
Literature Reference Author Y.P.LIU,G.CHEN,H.F.WANG,X.L.ZHANG,Y.H.PEI
Literature Reference Citation J.AS.NAT.PROD.RES.,16,281(2014)
Molecular Weight 226.290 g/mol
Solvent CDCl3
Source File Reference UWPA9082