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1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(4-methylphenyl)-
SpectraBase Compound ID 11P6BSmFmA8
InChI InChI=1S/C17H15BrFN5O/c1-10-2-6-13(7-3-10)21-17(25)15-16(20)24(23-22-15)9-11-4-5-12(18)8-14(11)19/h2-8H,9,20H2,1H3,(H,21,25)
InChIKey SWDBGMKTFVRYKF-UHFFFAOYSA-N
Mol Weight 404.24 g/mol
Molecular Formula C17H15BrFN5O
Exact Mass 403.044401 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DG0IyAJRY33
Name 1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(4-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.044401285 u
Formula C17H15BrFN5O
InChI InChI=1S/C17H15BrFN5O/c1-10-2-6-13(7-3-10)21-17(25)15-16(20)24(23-22-15)9-11-4-5-12(18)8-14(11)19/h2-8H,9,20H2,1H3,(H,21,25)
InChIKey SWDBGMKTFVRYKF-UHFFFAOYSA-N
Molecular Weight 404.243 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4309
Solvent DMSO-d6
Source Vendor ID: NMR/13279885