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2-METHYL-3-(3,5-DIIODO-4-HYDROXYBENZYL)-BENZOFURAN
SpectraBase Compound ID BkjBnxZUWCV
InChI InChI=1S/C16H12I2O2/c1-9-12(11-4-2-3-5-15(11)20-9)6-10-7-13(17)16(19)14(18)8-10/h2-5,7-8,19H,6H2,1H3
InChIKey ZHAMIXFCKGNYMT-UHFFFAOYSA-N
Mol Weight 490.08 g/mol
Molecular Formula C16H12I2O2
Exact Mass 489.89267 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 21qOVNYSjcd
Name 2-METHYL-3-(3,5-DIIODO-4-HYDROXYBENZYL)-BENZOFURAN
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12I2O2
InChI InChI=1S/C16H12I2O2/c1-9-12(11-4-2-3-5-15(11)20-9)6-10-7-13(17)16(19)14(18)8-10/h2-5,7-8,19H,6H2,1H3
InChIKey ZHAMIXFCKGNYMT-UHFFFAOYSA-N
Literature Reference Author B.CARLSSON,B.N.SINGH,M.TEMCIUC,S.NILSSON,Y.L.LI,C.MELLIN,J.M ALM
Literature Reference Citation J.MED.CHEM.,45,623(2002)
Literature Reference DOI 10.1021/jm001126+
Molecular Weight 490.079 g/mol
Sample ID 40931
Solvent ACETONE-D6