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N-(4-fluorobenzyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Bm2xzYJeH4A
InChI InChI=1S/C22H18FN5OS/c23-18-8-6-16(7-9-18)14-25-20(29)15-30-22-27-26-21(17-10-12-24-13-11-17)28(22)19-4-2-1-3-5-19/h1-13H,14-15H2,(H,25,29)
InChIKey DSSKNRHLWJEWQR-UHFFFAOYSA-N
Mol Weight 419.48 g/mol
Molecular Formula C22H18FN5OS
Exact Mass 419.12161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5UxiRkm1hUF
Name N-(4-fluorobenzyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 419.121609556 u
Formula C22H18FN5OS
InChI InChI=1S/C22H18FN5OS/c23-18-8-6-16(7-9-18)14-25-20(29)15-30-22-27-26-21(17-10-12-24-13-11-17)28(22)19-4-2-1-3-5-19/h1-13H,14-15H2,(H,25,29)
InChIKey DSSKNRHLWJEWQR-UHFFFAOYSA-N
Molecular Weight 419.478 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4476
Solvent DMSO-d6
Source Vendor ID: NMR/12309419