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N-(2-bromo-4,6-difluorophenyl)-2-{[5-(3-methylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID AqK5aWQoEUl
InChI InChI=1S/C24H19BrF2N4OS/c1-14-6-8-18(9-7-14)31-23(16-5-3-4-15(2)10-16)29-30-24(31)33-13-21(32)28-22-19(25)11-17(26)12-20(22)27/h3-12H,13H2,1-2H3,(H,28,32)
InChIKey GKXVTXPBZQQULC-UHFFFAOYSA-N
Mol Weight 529.4 g/mol
Molecular Formula C24H19BrF2N4OS
Exact Mass 528.043102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GZ3ONLX5Clv
Name N-(2-bromo-4,6-difluorophenyl)-2-{[5-(3-methylphenyl)-4-(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/C24H19BrF2N4OS/c1-14-6-8-18(9-7-14)31-23(16-5-3-4-15(2)10-16)29-30-24(31)33-13-21(32)28-22-19(25)11-17(26)12-20(22)27/h3-12H,13H2,1-2H3,(H,28,32)
InChIKey GKXVTXPBZQQULC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11388
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: E06915; Labnumber: GRES-31568; SBI_ID: SBI-011391
Temperature 318 °C