4-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic acid

SpectraBase Compound ID	K5rVhEtLQ9i
InChI	InChI=1S/C21H21N3O3/c1-3-24(4-2)19-11-5-15(6-12-19)13-17(14-22)20(25)23-18-9-7-16(8-10-18)21(26)27/h5-13H,3-4H2,1-2H3,(H,23,25)(H,26,27)/b17-13+
InChIKey	JPTTYGFYSBCARQ-GHRIWEEISA-N Google Search
Mol Weight	363.42 g/mol
Molecular Formula	C21H21N3O3
Exact Mass	363.158292 g/mol

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SpectraBase Spectrum ID	Ksw3IBTDIxS
Name	4-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic 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/C21H21N3O3/c1-3-24(4-2)19-11-5-15(6-12-19)13-17(14-22)20(25)23-18-9-7-16(8-10-18)21(26)27/h5-13H,3-4H2,1-2H3,(H,23,25)(H,26,27)/b17-13+
InChIKey	JPTTYGFYSBCARQ-GHRIWEEISA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_12262
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: 1002256; UBI_ID: UBI-012265
Synonyms	4-({2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic acid
Temperature	313 °C