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2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
SpectraBase Compound ID 2rihm1hKiHo
InChI InChI=1S/C22H24FN3OS/c1-5-26-20(16-6-10-17(11-7-16)22(2,3)4)24-25-21(26)28-14-19(27)15-8-12-18(23)13-9-15/h6-13H,5,14H2,1-4H3
InChIKey VQUZPWLIWVOXLA-UHFFFAOYSA-N
Mol Weight 397.51 g/mol
Molecular Formula C22H24FN3OS
Exact Mass 397.162412 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1dPBayXvqD9
Name 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
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/C22H24FN3OS/c1-5-26-20(16-6-10-17(11-7-16)22(2,3)4)24-25-21(26)28-14-19(27)15-8-12-18(23)13-9-15/h6-13H,5,14H2,1-4H3
InChIKey VQUZPWLIWVOXLA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14288
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: D98079; Labnumber: GRES-15424; SBI_ID: SBI-014291
Temperature 308 °C