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3-methylbenzyl 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl sulfide

View entire compound with spectra: 2 NMR

3-methylbenzyl 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl sulfide
SpectraBase Compound ID 9BANjma9bfb
InChI InChI=1S/C23H21N3S/c1-17-11-13-20(14-12-17)22-24-25-23(26(22)21-9-4-3-5-10-21)27-16-19-8-6-7-18(2)15-19/h3-15H,16H2,1-2H3
InChIKey ABEDLAIDNHVSRJ-UHFFFAOYSA-N
Mol Weight 371.5 g/mol
Molecular Formula C23H21N3S
Exact Mass 371.145619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ZQrKDmlmQJ
Name 3-methylbenzyl 5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl sulfide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H21N3S/c1-17-11-13-20(14-12-17)22-24-25-23(26(22)21-9-4-3-5-10-21)27-16-19-8-6-7-18(2)15-19/h3-15H,16H2,1-2H3
InChIKey ABEDLAIDNHVSRJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14573
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D98714; Labnumber: GRES-25352; SBI_ID: SBI-014576
Synonyms 3-[(3-methylbenzyl)sulfanyl]-5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazole
Temperature 318 °C