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2-{[4-(2-furylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
SpectraBase Compound ID JDL7Ljduffq
InChI InChI=1S/C22H20N4O3S/c1-28-19-12-6-5-11-18(19)23-20(27)15-30-22-25-24-21(16-8-3-2-4-9-16)26(22)14-17-10-7-13-29-17/h2-13H,14-15H2,1H3,(H,23,27)
InChIKey VQBKEVZJEHCZEH-UHFFFAOYSA-N
Mol Weight 420.49 g/mol
Molecular Formula C22H20N4O3S
Exact Mass 420.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KEGmUCuIDaa
Name 2-{[4-(2-furylmethyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)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/C22H20N4O3S/c1-28-19-12-6-5-11-18(19)23-20(27)15-30-22-25-24-21(16-8-3-2-4-9-16)26(22)14-17-10-7-13-29-17/h2-13H,14-15H2,1H3,(H,23,27)
InChIKey VQBKEVZJEHCZEH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14313
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: D98170; Labnumber: GRES-16802; SBI_ID: SBI-014316
Temperature 318 °C