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(1SR,4SR,4aRS,9aSR)-4-Ethoxy-5-hydroxy-1-methoxy-2-oxo-3,4,4a,9a-tetrahydro-1H-9,10-anthraquinone
SpectraBase Compound ID 1fhCfG3iDWC
InChI InChI=1S/C17H18O6/c1-3-23-11-7-10(19)17(22-2)14-13(11)16(21)12-8(15(14)20)5-4-6-9(12)18/h4-6,11,13-14,17-18H,3,7H2,1-2H3/t11-,13-,14+,17+/m0/s1
InChIKey LLABKXHYHUTQKV-HVOFVXBASA-N
Mol Weight 318.33 g/mol
Molecular Formula C17H18O6
Exact Mass 318.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5baLIqDrup5
Name (1SR,4SR,4ARS,9ASR)-4-ETHOXY-5-HYDROXY-1-METHOXY-2-OXO-3,4,4A,9A-TETRAHYDRO-1H-9,10-ANTHRAQUINONE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18O6
InChI InChI=1S/C17H18O6/c1-3-23-11-7-10(19)17(22-2)14-13(11)16(21)12-8(15(14)20)5-4-6-9(12)18/h4-6,11,13-14,17-18H,3,7H2,1-2H3/t11-,13-,14+,17+/m0/s1
InChIKey LLABKXHYHUTQKV-HVOFVXBASA-N
Literature Reference Author L.F.TIETZE,C.GUENTNER,K.M.GERICKE,I.SCHUBERTH,G.BUNKOCZI
Literature Reference Citation EUR.J.ORG.CHEM.,2459(2005)
Molecular Weight 318.326 g/mol
Sample ID 39407
Solvent CDCl3