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N-(3-chloro-4-fluorophenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 19CdltpH4Cv
InChI InChI=1S/C19H18ClFN4OS/c1-3-25-18(13-6-4-12(2)5-7-13)23-24-19(25)27-11-17(26)22-14-8-9-16(21)15(20)10-14/h4-10H,3,11H2,1-2H3,(H,22,26)
InChIKey KEBBOSFGTWAGER-UHFFFAOYSA-N
Mol Weight 404.89 g/mol
Molecular Formula C19H18ClFN4OS
Exact Mass 404.087388 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GnlWJD4UpHg
Name N-(3-chloro-4-fluorophenyl)-2-{[4-ethyl-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/C19H18ClFN4OS/c1-3-25-18(13-6-4-12(2)5-7-13)23-24-19(25)27-11-17(26)22-14-8-9-16(21)15(20)10-14/h4-10H,3,11H2,1-2H3,(H,22,26)
InChIKey KEBBOSFGTWAGER-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4555
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: D99167; Labnumber: GRES-32421; SBI_ID: SBI-004557
Temperature 315 °C