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benzoic acid, 3-[(4Z)-4-[(3,5-dibromo-4-hydroxyphenyl)methylene]-4,5-dihydro-5-oxo-3-(trifluoromethyl)-1H-pyrazol-1-yl]-
SpectraBase Compound ID 11XiL74Vuwb
InChI InChI=1S/C18H9Br2F3N2O4/c19-12-5-8(6-13(20)14(12)26)4-11-15(18(21,22)23)24-25(16(11)27)10-3-1-2-9(7-10)17(28)29/h1-7,26H,(H,28,29)/b11-4-
InChIKey BDGKRRGVOMGZHW-WCIBSUBMSA-N
Mol Weight 534.08 g/mol
Molecular Formula C18H9Br2F3N2O4
Exact Mass 531.888117 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E9CfMoqU4dQ
Name benzoic acid, 3-[(4Z)-4-[(3,5-dibromo-4-hydroxyphenyl)methylene]-4,5-dihydro-5-oxo-3-(trifluoromethyl)-1H-pyrazol-1-yl]-
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/C18H9Br2F3N2O4/c19-12-5-8(6-13(20)14(12)26)4-11-15(18(21,22)23)24-25(16(11)27)10-3-1-2-9(7-10)17(28)29/h1-7,26H,(H,28,29)/b11-4-
InChIKey BDGKRRGVOMGZHW-WCIBSUBMSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1206
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/11259315