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

SpectraBase Compound ID	EQG02abbAmh
InChI	InChI=1S/C21H13BrN2O4/c22-16-4-6-17(7-5-16)24-20(25)15(12-23)11-18-8-9-19(28-18)13-2-1-3-14(10-13)21(26)27/h1-11H,(H,24,25)(H,26,27)/b15-11+
InChIKey	HAWMDOFJCWBFGQ-RVDMUPIBSA-N Google Search
Mol Weight	437.25 g/mol
Molecular Formula	C21H13BrN2O4
Exact Mass	436.00587 g/mol

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SpectraBase Spectrum ID	CriedyRojU8
Name	3-{5-[(1E)-3-(4-bromoanilino)-2-cyano-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/C21H13BrN2O4/c22-16-4-6-17(7-5-16)24-20(25)15(12-23)11-18-8-9-19(28-18)13-2-1-3-14(10-13)21(26)27/h1-11H,(H,24,25)(H,26,27)/b15-11+
InChIKey	HAWMDOFJCWBFGQ-RVDMUPIBSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_2773
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/1010805; Labnumber: ARF3681; UZI_ID: UZI-002775
Synonyms	3-{5-[3-(4-bromoanilino)-2-cyano-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature	315 °C