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(3R,4S)-5-Bromo-9-hydroxy-8-methoxy-4-[(2-methoxyethoxy)-methoxy]-3-methyl-2,3,4,9-tetrahydro-1H-xanthen-1-one
SpectraBase Compound ID H4lJ1IG1ZF6
InChI InChI=1S/C19H23BrO7/c1-10-8-12(21)14-16(22)15-13(24-3)5-4-11(20)18(15)27-19(14)17(10)26-9-25-7-6-23-2/h4-5,10,16-17,22H,6-9H2,1-3H3/t10-,16?,17+/m1/s1
InChIKey RGOZWDANTUGBCR-LBWOKNEMSA-N
Mol Weight 443.29 g/mol
Molecular Formula C19H23BrO7
Exact Mass 442.062716 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FpMgD5f3Ty4
Name (3R,4S)-5-BROMO-9-HYDROXY-8-METHOXY-4-[(2-METHOXYETHOXY)-METHOXY]-3-METHYL-2,3,4,9-TETRAHYDRO-1H-XANTHEN-1-ONE
Compound Number 56
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23BrO7
InChI InChI=1S/C19H23BrO7/c1-10-8-12(21)14-16(22)15-13(24-3)5-4-11(20)18(15)27-19(14)17(10)26-9-25-7-6-23-2/h4-5,10,16-17,22H,6-9H2,1-3H3/t10-,16?,17+/m1/s1
InChIKey RGOZWDANTUGBCR-LBWOKNEMSA-N
Literature Reference Author A.C.MEISTER,A.ENCINAS,H.SAHIN,E.M.C.SINGER,C.F.NISING,M.NIEG ER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2014,4861(2014)
Literature Reference DOI 10.1002/ejoc.201402083
Molecular Weight 443.291 g/mol
Solvent CDCl3
Source File Reference UWIR19897