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4-allyl-3-[(3-chlorobenzyl)sulfanyl]-5-(3-methoxyphenyl)-4H-1,2,4-triazole
SpectraBase Compound ID LuZLHtwmOmX
InChI InChI=1S/C19H18ClN3OS/c1-3-10-23-18(15-7-5-9-17(12-15)24-2)21-22-19(23)25-13-14-6-4-8-16(20)11-14/h3-9,11-12H,1,10,13H2,2H3
InChIKey DMZWRARGEDCWGW-UHFFFAOYSA-N
Mol Weight 371.89 g/mol
Molecular Formula C19H18ClN3OS
Exact Mass 371.085911 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5uKnqk02IDf
Name 4-allyl-3-[(3-chlorobenzyl)sulfanyl]-5-(3-methoxyphenyl)-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/C19H18ClN3OS/c1-3-10-23-18(15-7-5-9-17(12-15)24-2)21-22-19(23)25-13-14-6-4-8-16(20)11-14/h3-9,11-12H,1,10,13H2,2H3
InChIKey DMZWRARGEDCWGW-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4874
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: E08292; Labnumber: GRES-36887; SBI_ID: SBI-004876
Synonyms 3-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl methyl ether
Temperature 315 °C