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(TRANS)-(3R,4S,4AR)-7-BROMO-8-METHOXY-4-[(2-METHOXYETHOXY)-METHOXY]-3-METHYL-2,3,4,4A-TETRAHYDRO-1H-XANTHEN-1-ONE
SpectraBase Compound ID 1UuLJr6jCaA
InChI InChI=1S/C19H23BrO6/c1-11-8-15(21)12-9-13-16(5-4-14(20)18(13)23-3)26-19(12)17(11)25-10-24-7-6-22-2/h4-5,9,11,17,19H,6-8,10H2,1-3H3/t11-,17+,19-/m1/s1
InChIKey RZPBZXSXMYGHBC-XTDINYQCSA-N
Mol Weight 427.29 g/mol
Molecular Formula C19H23BrO6
Exact Mass 426.067801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AuyuHl9OhYJ
Name (TRANS)-(3R,4S,4AR)-7-BROMO-8-METHOXY-4-[(2-METHOXYETHOXY)-METHOXY]-3-METHYL-2,3,4,4A-TETRAHYDRO-1H-XANTHEN-1-ONE
Compound Number 79
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23BrO6
InChI InChI=1S/C19H23BrO6/c1-11-8-15(21)12-9-13-16(5-4-14(20)18(13)23-3)26-19(12)17(11)25-10-24-7-6-22-2/h4-5,9,11,17,19H,6-8,10H2,1-3H3/t11-,17+,19-/m1/s1
InChIKey RZPBZXSXMYGHBC-XTDINYQCSA-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 427.292 g/mol
Solvent CDCl3
Source File Reference UWIR19913