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4,5-Diphenyl-2-piperidin-1-ylmethyl-2,4-dihydro-[1,2,4]triazole-3-thione
SpectraBase Compound ID 7PdP9P0bcN5
InChI InChI=1S/C20H22N4S/c25-20-23(16-22-14-8-3-9-15-22)21-19(17-10-4-1-5-11-17)24(20)18-12-6-2-7-13-18/h1-2,4-7,10-13H,3,8-9,14-16H2
InChIKey WCQYBGJFZCQXDB-UHFFFAOYSA-N
Mol Weight 350.48 g/mol
Molecular Formula C20H22N4S
Exact Mass 350.156518 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DGwX7xsCEBo
Name 3H-1,2,4-triazole-3-thione, 2,4-dihydro-4,5-diphenyl-2-(1-piperidinylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.156517898 u
Formula C20H22N4S
InChI InChI=1S/C20H22N4S/c25-20-23(16-22-14-8-3-9-15-22)21-19(17-10-4-1-5-11-17)24(20)18-12-6-2-7-13-18/h1-2,4-7,10-13H,3,8-9,14-16H2
InChIKey WCQYBGJFZCQXDB-UHFFFAOYSA-N
Molecular Weight 350.484 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15069
Solvent DMSO-d6
Source Vendor ID: NMR/10300161; Lab Info: LP; Lab Number: LP-2108638