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1H-1,2,4-triazol-5-amine, 1-(4-fluorobenzoyl)-N-[(4-methoxyphenyl)methyl]-3-phenyl-
SpectraBase Compound ID 5K8B0rYnZcW
InChI InChI=1S/C23H19FN4O2/c1-30-20-13-7-16(8-14-20)15-25-23-26-21(17-5-3-2-4-6-17)27-28(23)22(29)18-9-11-19(24)12-10-18/h2-14H,15H2,1H3,(H,25,26,27)
InChIKey BWMWSXTUOGEBQK-UHFFFAOYSA-N
Mol Weight 402.43 g/mol
Molecular Formula C23H19FN4O2
Exact Mass 402.149204 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AdmAzYTlE75
Name 1H-1,2,4-triazol-5-amine, 1-(4-fluorobenzoyl)-N-[(4-methoxyphenyl)methyl]-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 402.149204029 u
Formula C23H19FN4O2
InChI InChI=1S/C23H19FN4O2/c1-30-20-13-7-16(8-14-20)15-25-23-26-21(17-5-3-2-4-6-17)27-28(23)22(29)18-9-11-19(24)12-10-18/h2-14H,15H2,1H3,(H,25,26,27)
InChIKey BWMWSXTUOGEBQK-UHFFFAOYSA-N
Molecular Weight 402.429 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7760
Solvent DMSO-d6
Source Vendor ID: NMR/13308598