[4-((E)-{(3E)-3-[4-(carboxymethoxy)-3-chloro-5-ethoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-chloro-6-ethoxyphenoxy]acetic acid

SpectraBase Compound ID	2H2tPJ6GaUJ
InChI	InChI=1S/C27H26Cl2O9/c1-3-35-21-11-15(9-19(28)26(21)37-13-23(30)31)7-17-5-6-18(25(17)34)8-16-10-20(29)27(38-14-24(32)33)22(12-16)36-4-2/h7-12H,3-6,13-14H2,1-2H3,(H,30,31)(H,32,33)/b17-7+,18-8+
InChIKey	PIRMNIIKVANEQX-ZEELXFFVSA-N Google Search
Mol Weight	565.4 g/mol
Molecular Formula	C27H26Cl2O9
Exact Mass	564.095388 g/mol

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SpectraBase Spectrum ID	1YUhBLl907e
Name	[4-((E)-{(3E)-3-[4-(carboxymethoxy)-3-chloro-5-ethoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-chloro-6-ethoxyphenoxy]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/C27H26Cl2O9/c1-3-35-21-11-15(9-19(28)26(21)37-13-23(30)31)7-17-5-6-18(25(17)34)8-16-10-20(29)27(38-14-24(32)33)22(12-16)36-4-2/h7-12H,3-6,13-14H2,1-2H3,(H,30,31)(H,32,33)/b17-7+,18-8+
InChIKey	PIRMNIIKVANEQX-ZEELXFFVSA-N
NMR Offset	16.0772
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_8753
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/9034954; UBI_ID: UBI-008756
Synonyms	[4-({3-[4-(carboxymethoxy)-3-chloro-5-ethoxybenzylidene]-2-oxocyclopentylidene}methyl)-2-chloro-6-ethoxyphenoxy]acetic acid
Temperature	303 °C