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2-({3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]benzoyl}amino)benzamide
SpectraBase Compound ID HxZvKjUmno1
InChI InChI=1S/C18H14BrN5O4/c19-14-10-23(22-17(14)24(27)28)9-11-4-3-5-12(8-11)18(26)21-15-7-2-1-6-13(15)16(20)25/h1-8,10H,9H2,(H2,20,25)(H,21,26)
InChIKey ZCSJNJCDUISAPQ-UHFFFAOYSA-N
Mol Weight 444.25 g/mol
Molecular Formula C18H14BrN5O4
Exact Mass 443.022917 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1eTIgeMSYp3
Name 2-({3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]benzoyl}amino)benzamide
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/C18H14BrN5O4/c19-14-10-23(22-17(14)24(27)28)9-11-4-3-5-12(8-11)18(26)21-15-7-2-1-6-13(15)16(20)25/h1-8,10H,9H2,(H2,20,25)(H,21,26)
InChIKey ZCSJNJCDUISAPQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3436
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/9165258; Labnumber: BAC_UAMK/010480; UZI_ID: UZI-003438
Temperature 318 °C