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[5-[(3-fluorobenzyl)sulfanyl]-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]methyl 4-methylphenyl ether
SpectraBase Compound ID LiPff9TUbm0
InChI InChI=1S/C22H20FN3O2S/c1-16-7-9-19(10-8-16)28-14-21-24-25-22(26(21)13-20-6-3-11-27-20)29-15-17-4-2-5-18(23)12-17/h2-12H,13-15H2,1H3
InChIKey JFWZOXCSQYCNAD-UHFFFAOYSA-N
Mol Weight 409.48 g/mol
Molecular Formula C22H20FN3O2S
Exact Mass 409.126026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5jtBAJTenOp
Name [5-[(3-fluorobenzyl)sulfanyl]-4-(2-furylmethyl)-4H-1,2,4-triazol-3-yl]methyl 4-methylphenyl ether
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/C22H20FN3O2S/c1-16-7-9-19(10-8-16)28-14-21-24-25-22(26(21)13-20-6-3-11-27-20)29-15-17-4-2-5-18(23)12-17/h2-12H,13-15H2,1H3
InChIKey JFWZOXCSQYCNAD-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11110
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: E06101; Labnumber: GRES-16103; SBI_ID: SBI-011113
Synonyms 3-[(3-fluorobenzyl)sulfanyl]-4-(2-furylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole
Temperature 306 °C