3-[(4Z)-4-(4-ethoxy-3-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid

SpectraBase Compound ID	7SMZS6bwzkc
InChI	InChI=1S/C21H20N2O5/c1-4-28-18-9-8-14(11-19(18)27-3)10-17-13(2)22-23(20(17)24)16-7-5-6-15(12-16)21(25)26/h5-12H,4H2,1-3H3,(H,25,26)/b17-10-
InChIKey	JWNBZZUWWUPJKC-YVLHZVERSA-N Google Search
Mol Weight	380.4 g/mol
Molecular Formula	C21H20N2O5
Exact Mass	380.137222 g/mol

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SpectraBase Spectrum ID	I9eeKS5Rd0r
Name	3-[(4Z)-4-(4-ethoxy-3-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]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/C21H20N2O5/c1-4-28-18-9-8-14(11-19(18)27-3)10-17-13(2)22-23(20(17)24)16-7-5-6-15(12-16)21(25)26/h5-12H,4H2,1-3H3,(H,25,26)/b17-10-
InChIKey	JWNBZZUWWUPJKC-YVLHZVERSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_9168
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/9041649; UBI_ID: UBI-009171
Synonyms	3-[4-(4-ethoxy-3-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Temperature	308 °C