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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 HGfe7zUFiIi
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-LWNYNHHKSA-N
Mol Weight 443.29 g/mol
Molecular Formula C19H23BrO7
Exact Mass 442.062716 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzMuBfEuJB1
Name (3R,4S)-5-Bromo-9-hydroxy-8-methoxy-4-[(2-methoxyethoxy)-methoxy]-3-methyl-2,3,4,9-tetrahydro-1H-xanthen-1-one
Alternate Name(s) (3R,4S,9S)-5-Bromo-9-hydroxy-8-methoxy-4-[(2-methoxyethoxy)-methoxy]-3-methyl-2,3,4,9-tetrahydro-1H-xanthen-1-one (3R,4S,9S)-5-bromo-9-hydroxy-8-methoxy-4-((2-methoxyethoxy)methoxy)-3-methyl-2,3,4,9-tetrahydro-1H-xanthen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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-LWNYNHHKSA-N
Molecular Weight 443.290 g/mol
SMILES O[C@]1(c2c(c(Br)ccc2OC)OC2=C1C(C[C@@](C)([C@@]2(OCOCCOC)[H])[H])=O)[H]
SPLASH splash10-000f-9006100000-5e0b5cbb018ac72ba664
Source of Spectrum U1-2014-4872-56
Wiley ID 1740774