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1H-1,2,4-triazol-5-amine, N-[(4-methoxyphenyl)methyl]-1-(1-oxo-3-phenylpropyl)-3-phenyl-
SpectraBase Compound ID 3XNApJ3xmA0
InChI InChI=1S/C25H24N4O2/c1-31-22-15-12-20(13-16-22)18-26-25-27-24(21-10-6-3-7-11-21)28-29(25)23(30)17-14-19-8-4-2-5-9-19/h2-13,15-16H,14,17-18H2,1H3,(H,26,27,28)
InChIKey FQKQSMIRFZWUCA-UHFFFAOYSA-N
Mol Weight 412.49 g/mol
Molecular Formula C25H24N4O2
Exact Mass 412.189926 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BuImlNsqUot
Name 1H-1,2,4-triazol-5-amine, N-[(4-methoxyphenyl)methyl]-1-(1-oxo-3-phenylpropyl)-3-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.189926027 u
Formula C25H24N4O2
InChI InChI=1S/C25H24N4O2/c1-31-22-15-12-20(13-16-22)18-26-25-27-24(21-10-6-3-7-11-21)28-29(25)23(30)17-14-19-8-4-2-5-9-19/h2-13,15-16H,14,17-18H2,1H3,(H,26,27,28)
InChIKey FQKQSMIRFZWUCA-UHFFFAOYSA-N
Molecular Weight 412.493 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7758
Solvent DMSO-d6
Source Vendor ID: NMR/13308596