4-(1',4'-diphenyl-5-(thiophen-2-yl)-4,5-dihydro-1H,1'H-[3,3'-bipyrazol]-1-yl)-4-oxobutanoic acid

SpectraBase Compound ID	HJOBQp3kQop
InChI	InChI=1S/C26H22N4O3S/c31-24(13-14-25(32)33)30-22(23-12-7-15-34-23)16-21(27-30)26-20(18-8-3-1-4-9-18)17-29(28-26)19-10-5-2-6-11-19/h1-12,15,17,22H,13-14,16H2,(H,32,33)
InChIKey	LLHMWTLIGFZHQU-UHFFFAOYSA-N Google Search
Mol Weight	470.55 g/mol
Molecular Formula	C26H22N4O3S
Exact Mass	470.141262 g/mol

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SpectraBase Spectrum ID	KrZyLOutFxQ
Name	4-(1',4'-diphenyl-5-(thiophen-2-yl)-4,5-dihydro-1H,1'H-[3,3'-bipyrazol]-1-yl)-4-oxobutanoic 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/C26H22N4O3S/c31-24(13-14-25(32)33)30-22(23-12-7-15-34-23)16-21(27-30)26-20(18-8-3-1-4-9-18)17-29(28-26)19-10-5-2-6-11-19/h1-12,15,17,22H,13-14,16H2,(H,32,33)
InChIKey	LLHMWTLIGFZHQU-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_7636
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: 129726; Labnumber: FCI493-0060; VK_ID: VK-007640
Temperature	308 °C