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[4-((E)-{(3E)-5-tert-butyl-3-[4-(carboxymethoxy)-3-methoxybenzylidene]-2-oxocyclohexylidene}methyl)-2-methoxyphenoxy]acetic acid
SpectraBase Compound ID Bmwb0rlFHqk
InChI InChI=1S/C30H34O9/c1-30(2,3)22-14-20(10-18-6-8-23(25(12-18)36-4)38-16-27(31)32)29(35)21(15-22)11-19-7-9-24(26(13-19)37-5)39-17-28(33)34/h6-13,22H,14-17H2,1-5H3,(H,31,32)(H,33,34)/b20-10+,21-11+
InChIKey URVNYTCPFUASRZ-CLVAPQHMSA-N
Mol Weight 538.6 g/mol
Molecular Formula C30H34O9
Exact Mass 538.220283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 84lxbS6xrzG
Name [4-((E)-{(3E)-5-tert-butyl-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/C30H34O9/c1-30(2,3)22-14-20(10-18-6-8-23(25(12-18)36-4)38-16-27(31)32)29(35)21(15-22)11-19-7-9-24(26(13-19)37-5)39-17-28(33)34/h6-13,22H,14-17H2,1-5H3,(H,31,32)(H,33,34)/b20-10+,21-11+
InChIKey URVNYTCPFUASRZ-CLVAPQHMSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4834
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/9182372; Labnumber: BMA-041576; UZI_ID: UZI-004836
Synonyms [4-({5-tert-butyl-3-[4-(carboxymethoxy)-3-methoxybenzylidene]-2-oxocyclohexylidene}methyl)-2-methoxyphenoxy]acetic acid
Temperature 308 °C