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4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-mesitylbenzamide
SpectraBase Compound ID CcumlsUQBFx
InChI InChI=1S/C20H19BrN4O3/c1-12-8-13(2)18(14(3)9-12)22-20(26)16-6-4-15(5-7-16)10-24-11-17(21)19(23-24)25(27)28/h4-9,11H,10H2,1-3H3,(H,22,26)
InChIKey ZEPMJGACNWBLEC-UHFFFAOYSA-N
Mol Weight 443.3 g/mol
Molecular Formula C20H19BrN4O3
Exact Mass 442.064053 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JLoUwMlgvfS
Name 4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-mesitylbenzamide
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/C20H19BrN4O3/c1-12-8-13(2)18(14(3)9-12)22-20(26)16-6-4-15(5-7-16)10-24-11-17(21)19(23-24)25(27)28/h4-9,11H,10H2,1-3H3,(H,22,26)
InChIKey ZEPMJGACNWBLEC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3134
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/9149511; Labnumber: BAC_UAMK/003428; UZI_ID: UZI-003136
Temperature 308 °C