3-[(4E)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid

SpectraBase Compound ID	A27H2JTOuyf
InChI	InChI=1S/C26H30N2O4/c1-15-19(23(30)28(27-15)18-10-8-9-17(14-18)24(31)32)11-16-12-20(25(2,3)4)22(29)21(13-16)26(5,6)7/h8-14,29H,1-7H3,(H,31,32)/b19-11+
InChIKey	DOBLKSVRRRSTEJ-YBFXNURJSA-N Google Search
Mol Weight	434.54 g/mol
Molecular Formula	C26H30N2O4
Exact Mass	434.220557 g/mol

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SpectraBase Spectrum ID	2G6f8fm3H3n
Name	3-[(4E)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-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/C26H30N2O4/c1-15-19(23(30)28(27-15)18-10-8-9-17(14-18)24(31)32)11-16-12-20(25(2,3)4)22(29)21(13-16)26(5,6)7/h8-14,29H,1-7H3,(H,31,32)/b19-11+
InChIKey	DOBLKSVRRRSTEJ-YBFXNURJSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_5059
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/8070927; Labnumber: BMW-100850A; UZI_ID: UZI-005061
Synonyms	3-[4-(3,5-ditert-butyl-4-hydroxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Temperature	318 °C