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3-[(2,4-dichlorobenzyl)sulfanyl]-4-(2-furylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
SpectraBase Compound ID FWn8JFmBW9n
InChI InChI=1S/C21H17Cl2N3OS/c1-14-4-2-5-15(10-14)20-24-25-21(26(20)12-18-6-3-9-27-18)28-13-16-7-8-17(22)11-19(16)23/h2-11H,12-13H2,1H3
InChIKey OIJSPIZRUZJFCY-UHFFFAOYSA-N
Mol Weight 430.35 g/mol
Molecular Formula C21H17Cl2N3OS
Exact Mass 429.046939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Imq8ajeYTvT
Name 3-[(2,4-dichlorobenzyl)sulfanyl]-4-(2-furylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H17Cl2N3OS/c1-14-4-2-5-15(10-14)20-24-25-21(26(20)12-18-6-3-9-27-18)28-13-16-7-8-17(22)11-19(16)23/h2-11H,12-13H2,1H3
InChIKey OIJSPIZRUZJFCY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4840
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: E08229; Labnumber: GRES-36810; SBI_ID: SBI-004842
Synonyms 2,4-dichlorobenzyl 4-(2-furylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl sulfide
Temperature 315 °C