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(4E)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one

View entire compound with spectra: 1 NMR

(4E)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 9L4ZVEhwYFP
InChI InChI=1S/C26H29F3N2O2/c1-15-19(23(33)31(30-15)18-10-8-9-17(14-18)26(27,28)29)11-16-12-20(24(2,3)4)22(32)21(13-16)25(5,6)7/h8-14,32H,1-7H3/b19-11+
InChIKey MWJBJPKNMMQDKY-YBFXNURJSA-N
Mol Weight 458.53 g/mol
Molecular Formula C26H29F3N2O2
Exact Mass 458.218113 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FzZxB3wF1Ra
Name (4E)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
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/C26H29F3N2O2/c1-15-19(23(33)31(30-15)18-10-8-9-17(14-18)26(27,28)29)11-16-12-20(24(2,3)4)22(32)21(13-16)25(5,6)7/h8-14,32H,1-7H3/b19-11+
InChIKey MWJBJPKNMMQDKY-YBFXNURJSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6846
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/8189035; UBI_ID: UBI-006848
Synonyms 4-(3,5-ditert-butyl-4-hydroxybenzylidene)-5-methyl-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C