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2-METHYL-3-(3,5-DIIODO-4-CARBOXYMETHOXYBENZOYL)-BENZOFURAN
SpectraBase Compound ID 8Q1orxAYIrW
InChI InChI=1S/C18H12I2O5/c1-9-16(11-4-2-3-5-14(11)25-9)17(23)10-6-12(19)18(13(20)7-10)24-8-15(21)22/h2-7H,8H2,1H3,(H,21,22)
InChIKey LCTMPMFLXABADB-UHFFFAOYSA-N
Mol Weight 562.1 g/mol
Molecular Formula C18H12I2O5
Exact Mass 561.877413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SqwQbpm5Pd
Name 2-METHYL-3-(3,5-DIIODO-4-CARBOXYMETHOXYBENZOYL)-BENZOFURAN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H12I2O5
InChI InChI=1S/C18H12I2O5/c1-9-16(11-4-2-3-5-14(11)25-9)17(23)10-6-12(19)18(13(20)7-10)24-8-15(21)22/h2-7H,8H2,1H3,(H,21,22)
InChIKey LCTMPMFLXABADB-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 562.099 g/mol
Sample ID 40929
Solvent ACETONE-D6