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4-ethyl-3-[(3-fluorobenzyl)sulfanyl]-5-(4-methylphenyl)-4H-1,2,4-triazole

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4-ethyl-3-[(3-fluorobenzyl)sulfanyl]-5-(4-methylphenyl)-4H-1,2,4-triazole
SpectraBase Compound ID 5z9k6RDcNSc
InChI InChI=1S/C18H18FN3S/c1-3-22-17(15-9-7-13(2)8-10-15)20-21-18(22)23-12-14-5-4-6-16(19)11-14/h4-11H,3,12H2,1-2H3
InChIKey DWOOFJSAOKPTBC-UHFFFAOYSA-N
Mol Weight 327.42 g/mol
Molecular Formula C18H18FN3S
Exact Mass 327.120547 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K3I1C3QDTxy
Name 4-ethyl-3-[(3-fluorobenzyl)sulfanyl]-5-(4-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/C18H18FN3S/c1-3-22-17(15-9-7-13(2)8-10-15)20-21-18(22)23-12-14-5-4-6-16(19)11-14/h4-11H,3,12H2,1-2H3
InChIKey DWOOFJSAOKPTBC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4111
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: D98587; Labnumber: GRES-23247; SBI_ID: SBI-004113
Synonyms 4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl 3-fluorobenzyl sulfide
Temperature 318 °C