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N-(3,4-difluorophenyl)-2-{[4-(2-furylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 7NtnlC8LaJ5
InChI InChI=1S/C22H18F2N4O3S/c1-30-16-5-2-4-14(10-16)21-26-27-22(28(21)12-17-6-3-9-31-17)32-13-20(29)25-15-7-8-18(23)19(24)11-15/h2-11H,12-13H2,1H3,(H,25,29)
InChIKey JVKOFNPPHSPFIL-UHFFFAOYSA-N
Mol Weight 456.47 g/mol
Molecular Formula C22H18F2N4O3S
Exact Mass 456.106768 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CF8Bdrew2vz
Name N-(3,4-difluorophenyl)-2-{[4-(2-furylmethyl)-5-(3-methoxyphenyl)-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/C22H18F2N4O3S/c1-30-16-5-2-4-14(10-16)21-26-27-22(28(21)12-17-6-3-9-31-17)32-13-20(29)25-15-7-8-18(23)19(24)11-15/h2-11H,12-13H2,1H3,(H,25,29)
InChIKey JVKOFNPPHSPFIL-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11432
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: E06325; Labnumber: GRES-20548; SBI_ID: SBI-011435
Temperature 308 °C