2-butenoic acid, 4-[[4-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]amino]-4-oxo-, (2E)-

SpectraBase Compound ID	W66ISpgWxL
InChI	InChI=1S/C16H14F3N3O4/c1-22-15(20-11(23)7-8-12(24)25)13(14(21-22)16(17,18)19)9-3-5-10(26-2)6-4-9/h3-8H,1-2H3,(H,20,23)(H,24,25)/b8-7+
InChIKey	QUKQQIGKTLCMGW-BQYQJAHWSA-N Google Search
Mol Weight	369.3 g/mol
Molecular Formula	C16H14F3N3O4
Exact Mass	369.09364 g/mol

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SpectraBase Spectrum ID	IsdTwz8EWnF
Name	2-butenoic acid, 4-[[4-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]amino]-4-oxo-, (2E)-
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/C16H14F3N3O4/c1-22-15(20-11(23)7-8-12(24)25)13(14(21-22)16(17,18)19)9-3-5-10(26-2)6-4-9/h3-8H,1-2H3,(H,20,23)(H,24,25)/b8-7+
InChIKey	QUKQQIGKTLCMGW-BQYQJAHWSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_4465
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: NMR/17257895; Labnumber: FIL-0227