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s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-phenyl-

View entire compound with spectra: 2 NMR, and 1 MS (GC)

s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-phenyl-
SpectraBase Compound ID 9zddMz7A6hP
InChI InChI=1S/C21H17N3OS/c26-21-23-22-20(24(21)18-9-5-2-6-10-18)15-25-19-13-11-17(12-14-19)16-7-3-1-4-8-16/h1-14H,15H2,(H,23,26)
InChIKey YMTCAUNMUYRNKD-UHFFFAOYSA-N
Mol Weight 359.45 g/mol
Molecular Formula C21H17N3OS
Exact Mass 359.109233 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4G8220e0p5u
Name 4H-1,2,4-triazole-3-thiol, 5-[([1,1'-biphenyl]-4-yloxy)methyl]-4-phenyl-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.109233352 u
Formula C21H17N3OS
InChI InChI=1S/C21H17N3OS/c26-21-23-22-20(24(21)18-9-5-2-6-10-18)15-25-19-13-11-17(12-14-19)16-7-3-1-4-8-16/h1-14H,15H2,(H,23,26)
InChIKey YMTCAUNMUYRNKD-UHFFFAOYSA-N
Molecular Weight 359.447 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7576
Solvent DMSO-d6
Source Vendor ID: NMR/9312682; Lab Info: LP; Lab Number: LP-2191516