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N-(4-{(1E)-N-[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]ethanehydrazonoyl}phenyl)-3-fluorobenzamide
SpectraBase Compound ID GbB88gUQzMD
InChI InChI=1S/C20H17BrFN5O2/c1-12(25-26-20(29)18-17(21)11-23-27(18)2)13-6-8-16(9-7-13)24-19(28)14-4-3-5-15(22)10-14/h3-11H,1-2H3,(H,24,28)(H,26,29)/b25-12+
InChIKey PABDQYCSSQGXGJ-BRJLIKDPSA-N
Mol Weight 458.29 g/mol
Molecular Formula C20H17BrFN5O2
Exact Mass 457.054966 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KvEE7T7APsg
Name N-(4-{(1E)-N-[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]ethanehydrazonoyl}phenyl)-3-fluorobenzamide
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/C20H17BrFN5O2/c1-12(25-26-20(29)18-17(21)11-23-27(18)2)13-6-8-16(9-7-13)24-19(28)14-4-3-5-15(22)10-14/h3-11H,1-2H3,(H,24,28)(H,26,29)/b25-12+
InChIKey PABDQYCSSQGXGJ-BRJLIKDPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4598
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/9164871; Labnumber: BHY_UKE/01280; UZI_ID: UZI-004600
Synonyms N-(4-{N-[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]ethanehydrazonoyl}phenyl)-3-fluorobenzamide
Temperature 318 °C