{4-[(1E)-3-(benzylamino)-2-cyano-3-oxo-1-propenyl]-2,6-dichlorophenoxy}acetic acid

SpectraBase Compound ID	3WQEdbjMllD
InChI	InChI=1S/C19H14Cl2N2O4/c20-15-7-13(8-16(21)18(15)27-11-17(24)25)6-14(9-22)19(26)23-10-12-4-2-1-3-5-12/h1-8H,10-11H2,(H,23,26)(H,24,25)/b14-6+
InChIKey	DWCCERJGJKUWIS-MKMNVTDBSA-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	DxmTEXf3a9F
Name	{4-[(1E)-3-(benzylamino)-2-cyano-3-oxo-1-propenyl]-2,6-dichlorophenoxy}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/c20-15-7-13(8-16(21)18(15)27-11-17(24)25)6-14(9-22)19(26)23-10-12-4-2-1-3-5-12/h1-8H,10-11H2,(H,23,26)(H,24,25)/b14-6+
InChIKey	DWCCERJGJKUWIS-MKMNVTDBSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_11841
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: 1003888; UBI_ID: UBI-011844
Synonyms	{4-[3-(benzylamino)-2-cyano-3-oxo-1-propenyl]-2,6-dichlorophenoxy}acetic acid
Temperature	318 °C