2-(4-{(E)-[1-(3-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)acetamide

SpectraBase Compound ID	1fXLfCQ3INw
InChI	InChI=1S/C21H20BrN3O4/c1-3-28-19-10-14(7-8-18(19)29-12-20(23)26)9-17-13(2)24-25(21(17)27)16-6-4-5-15(22)11-16/h4-11H,3,12H2,1-2H3,(H2,23,26)/b17-9+
InChIKey	XQZHKFQYOMOOAY-RQZCQDPDSA-N Google Search
Mol Weight	458.31 g/mol
Molecular Formula	C21H20BrN3O4
Exact Mass	457.063719 g/mol

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SpectraBase Spectrum ID	B9EKrMNNpMI
Name	2-(4-{(E)-[1-(3-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)acetamide
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/C21H20BrN3O4/c1-3-28-19-10-14(7-8-18(19)29-12-20(23)26)9-17-13(2)24-25(21(17)27)16-6-4-5-15(22)11-16/h4-11H,3,12H2,1-2H3,(H2,23,26)/b17-9+
InChIKey	XQZHKFQYOMOOAY-RQZCQDPDSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_5052
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/8059371; Labnumber: BMW-100440A; UZI_ID: UZI-005054
Synonyms	2-(4-{[1-(3-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)acetamide
Temperature	308 °C