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REL-(4AS*,10AR*)-(+/-)-6,7-DIBROMO-4A-HYDROXY-3,8-DIHYDROXYMETHYL-10A-METHOXY-1,4,4A,10A-TETRAHYDRODIBENZO-[B,E]-[1,4]-DIOXIN-1-ONE

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REL-(4AS*,10AR*)-(+/-)-6,7-DIBROMO-4A-HYDROXY-3,8-DIHYDROXYMETHYL-10A-METHOXY-1,4,4A,10A-TETRAHYDRODIBENZO-[B,E]-[1,4]-DIOXIN-1-ONE
SpectraBase Compound ID GYBXpMI7DtF
InChI InChI=1S/C15H14Br2O7/c1-22-15-10(20)2-7(5-18)4-14(15,21)24-13-9(23-15)3-8(6-19)11(16)12(13)17/h2-3,18-19,21H,4-6H2,1H3
InChIKey OKQAIDYFZYZNBH-UHFFFAOYSA-N
Mol Weight 466.08 g/mol
Molecular Formula C15H14Br2O7
Exact Mass 463.910629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID uoLxXWsMfn
Name REL-(4AS*,10AR*)-(+/-)-6,7-DIBROMO-4A-HYDROXY-3,8-DIHYDROXYMETHYL-10A-METHOXY-1,4,4A,10A-TETRAHYDRODIBENZO-[B,E]-[1,4]-DIOXIN-1-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H14Br2O7
InChI InChI=1S/C15H14Br2O7/c1-22-15-10(20)2-7(5-18)4-14(15,21)24-13-9(23-15)3-8(6-19)11(16)12(13)17/h2-3,18-19,21H,4-6H2,1H3
InChIKey OKQAIDYFZYZNBH-UHFFFAOYSA-N
Literature Reference Author X.XU,F.SONG,S.WANG,S.LI,F.XIAO,J.ZHAO,Y.YANG,S.SHANG,L.YANG, J.SHI
Literature Reference Citation J.NAT.PROD.,67,1661(2004)
Literature Reference DOI 10.1021/np0400609
Molecular Weight 466.080 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ6555