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ethyl [4-((E)-{(3E)-3-[4-(2-ethoxy-2-oxoethoxy)-3-methoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-methoxyphenoxy]acetate

View entire compound with spectra: 2 NMR

ethyl [4-((E)-{(3E)-3-[4-(2-ethoxy-2-oxoethoxy)-3-methoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-methoxyphenoxy]acetate
SpectraBase Compound ID 143TKIIKJP3
InChI InChI=1S/C29H32O9/c1-5-35-27(30)17-37-23-11-7-19(15-25(23)33-3)13-21-9-10-22(29(21)32)14-20-8-12-24(26(16-20)34-4)38-18-28(31)36-6-2/h7-8,11-16H,5-6,9-10,17-18H2,1-4H3/b21-13+,22-14+
InChIKey UKUYKVZCKMVRTO-JFMUQQRKSA-N
Mol Weight 524.6 g/mol
Molecular Formula C29H32O9
Exact Mass 524.204633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgtMHGp9rrm
Name Ethyl [4-((E)-{(3E)-3-[4-(2-ethoxy-2-oxoethoxy)-3-methoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-methoxyphenoxy]acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 524.204632601 u
Formula C29H32O9
InChI InChI=1S/C29H32O9/c1-5-35-27(30)17-37-23-11-7-19(15-25(23)33-3)13-21-9-10-22(29(21)32)14-20-8-12-24(26(16-20)34-4)38-18-28(31)36-6-2/h7-8,11-16H,5-6,9-10,17-18H2,1-4H3/b21-13+,22-14+
InChIKey UKUYKVZCKMVRTO-JFMUQQRKSA-N
Molecular Weight 524.566 g/mol
SMILES C1(\C(CC\C1=C\C=1C=C(OC)C(=CC1)OCC(=O)OCC)=C\C1=CC(OC)=C(C=C1)OCC(=O)OCC)=O