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(Z)-1-[2'-(3''-Hydroxy-2"-iodo-4"-methoxyphenyl)-11'-ethenyl]-2-bromo-3,4,5-trimethoxybenzene
SpectraBase Compound ID 2VUy3bsIM6g
InChI InChI=1S/C18H18BrIO5/c1-22-12-8-7-10(15(20)16(12)21)5-6-11-9-13(23-2)17(24-3)18(25-4)14(11)19/h5-9,21H,1-4H3/b6-5-
InChIKey IWIBZKUEVFRXMF-WAYWQWQTSA-N
Mol Weight 521.15 g/mol
Molecular Formula C18H18BrIO5
Exact Mass 519.938232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqRYdB67ho4
Name (Z)-1-[2'-(3''-Hydroxy-2"-iodo-4"-methoxyphenyl)-11'-ethenyl]-2-bromo-3,4,5-trimethoxybenzene
Alternate Name(s) 3-[(Z)-2-(2-bromo-3,4,5-trimethoxyphenyl)ethenyl]-2-iodo-6-methoxyphenol 3-[(Z)-2-(2-bromanyl-3,4,5-trimethoxy-phenyl)ethenyl]-2-iodanyl-6-methoxy-phenol
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Formula C18H18BrIO5
InChI InChI=1S/C18H18BrIO5/c1-22-12-8-7-10(15(20)16(12)21)5-6-11-9-13(23-2)17(24-3)18(25-4)14(11)19/h5-9,21H,1-4H3/b6-5-
InChIKey IWIBZKUEVFRXMF-WAYWQWQTSA-N
Molecular Weight 521.145 g/mol
SMILES Oc1c(c(\C=C/c2c(c(c(c(OC)c2)OC)OC)Br)ccc1OC)I
SPLASH splash10-0k96-9552010000-dcebd52ef8c04c90e40f
Source of Spectrum D1-2006-2980-8
Wiley ID 1614326