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N-(2-bromo-4,6-difluorophenyl)-2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 4Ml4YGNN5xl
InChI InChI=1S/C19H17BrF2N4OS/c1-3-26-18(12-6-4-11(2)5-7-12)24-25-19(26)28-10-16(27)23-17-14(20)8-13(21)9-15(17)22/h4-9H,3,10H2,1-2H3,(H,23,27)
InChIKey NKKWDXQNWHLCGP-UHFFFAOYSA-N
Mol Weight 467.33 g/mol
Molecular Formula C19H17BrF2N4OS
Exact Mass 466.027452 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7l4VS85rPh
Name N-(2-bromo-4,6-difluorophenyl)-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/C19H17BrF2N4OS/c1-3-26-18(12-6-4-11(2)5-7-12)24-25-19(26)28-10-16(27)23-17-14(20)8-13(21)9-15(17)22/h4-9H,3,10H2,1-2H3,(H,23,27)
InChIKey NKKWDXQNWHLCGP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14502
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: D98611; Labnumber: GRES-23575; SBI_ID: SBI-014505
Temperature 308 °C