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

SpectraBase Compound ID	3Yvyo590Fr8
InChI	InChI=1S/C19H16N2O5/c20-12-13(18(22)21-7-9-25-10-8-21)11-14-5-6-17(26-14)15-3-1-2-4-16(15)19(23)24/h1-6,11H,7-10H2,(H,23,24)/b13-11+
InChIKey	BDFKJXHBUYCZHA-ACCUITESSA-N Google Search
Mol Weight	352.35 g/mol
Molecular Formula	C19H16N2O5
Exact Mass	352.105922 g/mol

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SpectraBase Spectrum ID	1KLnnaeHh3n
Name	2-{5-[(1E)-2-cyano-3-(4-morpholinyl)-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/C19H16N2O5/c20-12-13(18(22)21-7-9-25-10-8-21)11-14-5-6-17(26-14)15-3-1-2-4-16(15)19(23)24/h1-6,11H,7-10H2,(H,23,24)/b13-11+
InChIKey	BDFKJXHBUYCZHA-ACCUITESSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3096
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: D08994; Labnumber: SPZAM-5659; SBI_ID: SBI-003098
Synonyms	2-{5-[2-cyano-3-(4-morpholinyl)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature	315 °C