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3-(2-Iodo-3,4-dimethoxy-phenyl)-4,5-dimethoxy-3H-isobenzofuran-1-one
SpectraBase Compound ID HQEBxrm7Tj
InChI InChI=1S/C18H17IO6/c1-21-11-7-5-9-13(16(11)23-3)15(25-18(9)20)10-6-8-12(22-2)17(24-4)14(10)19/h5-8,15H,1-4H3
InChIKey KZCJISQQZBGWDT-UHFFFAOYSA-N
Mol Weight 456.23 g/mol
Molecular Formula C18H17IO6
Exact Mass 456.006983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImyCj0ex7Ne
Name 3-(2-Iodo-3,4-dimethoxy-phenyl)-4,5-dimethoxy-3H-isobenzofuran-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17IO6
InChI InChI=1S/C18H17IO6/c1-21-11-7-5-9-13(16(11)23-3)15(25-18(9)20)10-6-8-12(22-2)17(24-4)14(10)19/h5-8,15H,1-4H3
InChIKey KZCJISQQZBGWDT-UHFFFAOYSA-N
Molecular Weight 456.232 g/mol
SMILES c12C(OC(c2ccc(c1OC)OC)=O)c1c(c(OC)c(cc1)OC)I
SPLASH splash10-0a4i-0033900000-e90dbee04677ea59af0d
Source of Spectrum D1-2002-930-2
Synonyms 3-(2-iodo-3,4-dimethoxyphenyl)-4,5-dimethoxy-2-benzofuran-1(3H)-one 5-[2'-Iodo-3',4'-dimethoxyphenyl]-5,6-dimethoxy-2,5-dihydrobenzofuran-2-one
Wiley ID 1548096