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5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl 3-methylbenzyl sulfide

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5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl 3-methylbenzyl sulfide
SpectraBase Compound ID 3mqEhSiSxtk
InChI InChI=1S/C18H18ClN3S/c1-3-22-17(15-8-5-9-16(19)11-15)20-21-18(22)23-12-14-7-4-6-13(2)10-14/h4-11H,3,12H2,1-2H3
InChIKey LVYLTBIJYTXZMV-UHFFFAOYSA-N
Mol Weight 343.88 g/mol
Molecular Formula C18H18ClN3S
Exact Mass 343.090996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4yo9s0ykA8p
Name 5-(3-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl 3-methylbenzyl sulfide
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/C18H18ClN3S/c1-3-22-17(15-8-5-9-16(19)11-15)20-21-18(22)23-12-14-7-4-6-13(2)10-14/h4-11H,3,12H2,1-2H3
InChIKey LVYLTBIJYTXZMV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11338
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: E06646; Labnumber: GRES-26710; SBI_ID: SBI-011341
Synonyms 3-(3-chlorophenyl)-4-ethyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Temperature 308 °C