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N-(2-bromo-4,6-difluorophenyl)-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID FTEFNH0OPF9
InChI InChI=1S/C22H23BrF2N4OS/c1-5-29-20(13-6-8-14(9-7-13)22(2,3)4)27-28-21(29)31-12-18(30)26-19-16(23)10-15(24)11-17(19)25/h6-11H,5,12H2,1-4H3,(H,26,30)
InChIKey UZLSVSMZCYLSEE-UHFFFAOYSA-N
Mol Weight 509.41 g/mol
Molecular Formula C22H23BrF2N4OS
Exact Mass 508.074402 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GY6LGS0zbn2
Name N-(2-bromo-4,6-difluorophenyl)-2-{[5-(4-tert-butylphenyl)-4-ethyl-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/C22H23BrF2N4OS/c1-5-29-20(13-6-8-14(9-7-13)22(2,3)4)27-28-21(29)31-12-18(30)26-19-16(23)10-15(24)11-17(19)25/h6-11H,5,12H2,1-4H3,(H,26,30)
InChIKey UZLSVSMZCYLSEE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4425
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: D98992; Labnumber: GRES-29698; SBI_ID: SBI-004427
Temperature 308 °C