2-{5-[(1E)-2-cyano-3-(2,4-dimethylanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid

SpectraBase Compound ID	BZf7ztbB4d8
InChI	InChI=1S/C23H18N2O4/c1-14-7-9-20(15(2)11-14)25-22(26)16(13-24)12-17-8-10-21(29-17)18-5-3-4-6-19(18)23(27)28/h3-12H,1-2H3,(H,25,26)(H,27,28)/b16-12+
InChIKey	UHQLPPSPNBTZFX-FOWTUZBSSA-N Google Search
Mol Weight	386.41 g/mol
Molecular Formula	C23H18N2O4
Exact Mass	386.126657 g/mol

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SpectraBase Spectrum ID	3xoQKMqpfRb
Name	2-{5-[(1E)-2-cyano-3-(2,4-dimethylanilino)-3-oxo-1-propenyl]-2-furyl}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/C23H18N2O4/c1-14-7-9-20(15(2)11-14)25-22(26)16(13-24)12-17-8-10-21(29-17)18-5-3-4-6-19(18)23(27)28/h3-12H,1-2H3,(H,25,26)(H,27,28)/b16-12+
InChIKey	UHQLPPSPNBTZFX-FOWTUZBSSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_24660
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: D48257; Labnumber: SPZAM-7045; SBI_ID: SBI-024664
Synonyms	2-{5-[2-cyano-3-(2,4-dimethylanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature	303 °C