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1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(2,4-dimethylphenyl)-
SpectraBase Compound ID 2HTQpnmpbnI
InChI InChI=1S/C18H17BrFN5O/c1-10-3-6-15(11(2)7-10)22-18(26)16-17(21)25(24-23-16)9-12-4-5-13(19)8-14(12)20/h3-8H,9,21H2,1-2H3,(H,22,26)
InChIKey ZJDMXRMCIOSSFO-UHFFFAOYSA-N
Mol Weight 418.27 g/mol
Molecular Formula C18H17BrFN5O
Exact Mass 417.060051 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9PhmVCuE3y2
Name 1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(2,4-dimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.060051349 u
Formula C18H17BrFN5O
InChI InChI=1S/C18H17BrFN5O/c1-10-3-6-15(11(2)7-10)22-18(26)16-17(21)25(24-23-16)9-12-4-5-13(19)8-14(12)20/h3-8H,9,21H2,1-2H3,(H,22,26)
InChIKey ZJDMXRMCIOSSFO-UHFFFAOYSA-N
Molecular Weight 418.270 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4310
Solvent DMSO-d6
Source Vendor ID: NMR/13279886