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[4-((E)-{(3E)-3-[4-(carboxymethoxy)-3-methoxybenzylidene]-2-oxocyclohexylidene}methyl)-2-methoxyphenoxy]acetic acid
SpectraBase Compound ID JPOQisVCsRY
InChI InChI=1S/C26H26O9/c1-32-22-12-16(6-8-20(22)34-14-24(27)28)10-18-4-3-5-19(26(18)31)11-17-7-9-21(23(13-17)33-2)35-15-25(29)30/h6-13H,3-5,14-15H2,1-2H3,(H,27,28)(H,29,30)/b18-10+,19-11+
InChIKey DFGHDLNUYOKKQK-XOBNHNQQSA-N
Mol Weight 482.49 g/mol
Molecular Formula C26H26O9
Exact Mass 482.157682 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AyiIVMYL62E
Name [4-((E)-{(3E)-3-[4-(carboxymethoxy)-3-methoxybenzylidene]-2-oxocyclohexylidene}methyl)-2-methoxyphenoxy]acetic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H26O9/c1-32-22-12-16(6-8-20(22)34-14-24(27)28)10-18-4-3-5-19(26(18)31)11-17-7-9-21(23(13-17)33-2)35-15-25(29)30/h6-13H,3-5,14-15H2,1-2H3,(H,27,28)(H,29,30)/b18-10+,19-11+
InChIKey DFGHDLNUYOKKQK-XOBNHNQQSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4997
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/8024621; Labnumber: BMW-0082717; UZI_ID: UZI-004999
Synonyms [4-({3-[4-(carboxymethoxy)-3-methoxybenzylidene]-2-oxocyclohexylidene}methyl)-2-methoxyphenoxy]acetic acid
Temperature 308 °C