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2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID 2ypd6fRoxXx
InChI InChI=1S/C23H15Cl2F3N4OS/c24-16-9-6-14(7-10-16)21-30-31-22(32(21)17-4-2-1-3-5-17)34-13-20(33)29-19-12-15(23(26,27)28)8-11-18(19)25/h1-12H,13H2,(H,29,33)
InChIKey AYGDWSBDFZSKMD-UHFFFAOYSA-N
Mol Weight 523.36 g/mol
Molecular Formula C23H15Cl2F3N4OS
Exact Mass 522.029572 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IkiOAl6VcFz
Name 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]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/C23H15Cl2F3N4OS/c24-16-9-6-14(7-10-16)21-30-31-22(32(21)17-4-2-1-3-5-17)34-13-20(33)29-19-12-15(23(26,27)28)8-11-18(19)25/h1-12H,13H2,(H,29,33)
InChIKey AYGDWSBDFZSKMD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11700
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: E08617; Labnumber: GRES-37273; SBI_ID: SBI-011703
Temperature 308 °C