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3-(3-Iodo-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)acrylic acid ethyl ester
SpectraBase Compound ID 4I1EGjn0o9g
InChI InChI=1S/C21H23IO6/c1-6-28-21(23)15(14-7-8-17(24-2)18(12-14)25-3)9-13-10-16(22)20(27-5)19(11-13)26-4/h7-12H,6H2,1-5H3/b15-9+
InChIKey MXQCHJHIHXNARV-OQLLNIDSSA-N
Mol Weight 498.31 g/mol
Molecular Formula C21H23IO6
Exact Mass 498.053933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4nWBbWjzzR
Name 3-(3-Iodo-4,5-dimethoxyphenyl)-2-(3,4-dimethoxyphenyl)acrylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C21H23IO6
InChI InChI=1S/C21H23IO6/c1-6-28-21(23)15(14-7-8-17(24-2)18(12-14)25-3)9-13-10-16(22)20(27-5)19(11-13)26-4/h7-12H,6H2,1-5H3/b15-9+
InChIKey MXQCHJHIHXNARV-OQLLNIDSSA-N
Molecular Weight 498.313 g/mol
SMILES c1(\C(=C/c2cc(I)c(c(c2)OC)OC)C(=O)OCC)cc(OC)c(cc1)OC
SPLASH splash10-0002-0000900000-ca7daeb7d2a08fce9e9a
Source of Spectrum F4-0-2110-7
Synonyms ethyl (2E)-2-(3,4-dimethoxyphenyl)-3-(3-iodo-4,5-dimethoxyphenyl)-2-propenoate
Wiley ID 1620023