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threo-2-(2-(2-Bromo-4,5-dimethoxyphenyl)-1-iodoethyl)-4-methylenetetrahydrofuran
SpectraBase Compound ID 7uJU9mOh4wa
InChI InChI=1S/C15H18BrIO3/c1-9-4-13(20-8-9)12(17)5-10-6-14(18-2)15(19-3)7-11(10)16/h6-7,12-13H,1,4-5,8H2,2-3H3/t12-,13-/m1/s1
InChIKey WYQDEHPZBKQKJM-CHWSQXEVSA-N
Mol Weight 453.11 g/mol
Molecular Formula C15H18BrIO3
Exact Mass 451.948402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 751EK7sZ9uE
Name threo-2-(2-(2-Bromo-4,5-dimethoxyphenyl)-1-iodoethyl)-4-methylenetetrahydrofuran
Appearance White solid
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Formula C15H18BrIO3
InChI InChI=1S/C15H18BrIO3/c1-9-4-13(20-8-9)12(17)5-10-6-14(18-2)15(19-3)7-11(10)16/h6-7,12-13H,1,4-5,8H2,2-3H3/t12-,13-/m1/s1
InChIKey WYQDEHPZBKQKJM-CHWSQXEVSA-N
Instrument Name Agilent 6890-Hewlett Packard 5973
Ionization Type EI positive ion
Literature Reference DOI 10.3762/bjoc.11.18
Molecular Weight 453.114 g/mol
Reported Formula C15H18BrIO3
SMILES C(c1c(cc(c(c1)OC)OC)Br)[C@]([C@]1([H])OCC(=C)C1)(I)[H]
SPLASH splash10-004i-2290000000-dd6109bd83043bd9d010
Source of Spectrum BJO-11-SM40-5i
Wiley ID 1851575