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N-(4-fluorophenyl)-2-{[4-(2-furylmethyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID I1SbVchzzk
InChI InChI=1S/C22H19FN4O2S/c1-15-4-6-16(7-5-15)21-25-26-22(27(21)13-19-3-2-12-29-19)30-14-20(28)24-18-10-8-17(23)9-11-18/h2-12H,13-14H2,1H3,(H,24,28)
InChIKey PKSCBYBHHTYYCF-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C22H19FN4O2S
Exact Mass 422.121275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 17rb8CMWZqU
Name N-(4-fluorophenyl)-2-{[4-(2-furylmethyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C22H19FN4O2S/c1-15-4-6-16(7-5-15)21-25-26-22(27(21)13-19-3-2-12-29-19)30-14-20(28)24-18-10-8-17(23)9-11-18/h2-12H,13-14H2,1H3,(H,24,28)
InChIKey PKSCBYBHHTYYCF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4551
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: D99160; Labnumber: GRES-32342; SBI_ID: SBI-004553
Temperature 315 °C