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3-[(4-chlorophenoxy)methyl]-4-ethyl-5-[(3-fluorobenzyl)sulfanyl]-4H-1,2,4-triazole
SpectraBase Compound ID 1QClKmx2Ufh
InChI InChI=1S/C18H17ClFN3OS/c1-2-23-17(11-24-16-8-6-14(19)7-9-16)21-22-18(23)25-12-13-4-3-5-15(20)10-13/h3-10H,2,11-12H2,1H3
InChIKey TVWQPFKLWSDVEV-UHFFFAOYSA-N
Mol Weight 377.87 g/mol
Molecular Formula C18H17ClFN3OS
Exact Mass 377.076489 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5tEK0QtVjjl
Name 3-[(4-chlorophenoxy)methyl]-4-ethyl-5-[(3-fluorobenzyl)sulfanyl]-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/C18H17ClFN3OS/c1-2-23-17(11-24-16-8-6-14(19)7-9-16)21-22-18(23)25-12-13-4-3-5-15(20)10-13/h3-10H,2,11-12H2,1H3
InChIKey TVWQPFKLWSDVEV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11522
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: E06446; Labnumber: GRES-22745; SBI_ID: SBI-011525
Synonyms 4-chlorophenyl {4-ethyl-5-[(3-fluorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl ether
Temperature 308 °C