{2,6-dichloro-4-[(1E)-2-cyano-3-oxo-3-(3-toluidino)-1-propenyl]phenoxy}acetic acid

SpectraBase Compound ID	Jmw9evOUOdZ
InChI	InChI=1S/C19H14Cl2N2O4/c1-11-3-2-4-14(5-11)23-19(26)13(9-22)6-12-7-15(20)18(16(21)8-12)27-10-17(24)25/h2-8H,10H2,1H3,(H,23,26)(H,24,25)/b13-6+
InChIKey	FYADSFFSTNBGMX-AWNIVKPZSA-N Google Search
Mol Weight	405.24 g/mol
Molecular Formula	C19H14Cl2N2O4
Exact Mass	404.033062 g/mol

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SpectraBase Spectrum ID	LSt0rgKTOuA
Name	{2,6-dichloro-4-[(1E)-2-cyano-3-oxo-3-(3-toluidino)-1-propenyl]phenoxy}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/C19H14Cl2N2O4/c1-11-3-2-4-14(5-11)23-19(26)13(9-22)6-12-7-15(20)18(16(21)8-12)27-10-17(24)25/h2-8H,10H2,1H3,(H,23,26)(H,24,25)/b13-6+
InChIKey	FYADSFFSTNBGMX-AWNIVKPZSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11830
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: 1003027; UBI_ID: UBI-011833
Synonyms	{2,6-dichloro-4-[2-cyano-3-oxo-3-(3-toluidino)-1-propenyl]phenoxy}acetic acid
Temperature	318 °C