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2-{[5-(3-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 4KgBqisxpNu
InChI InChI=1S/C16H13BrN4OS/c17-12-6-4-5-11(9-12)15-19-20-16(23-10-14(18)22)21(15)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,22)
InChIKey CKZXTFXCCLDLCB-UHFFFAOYSA-N
Mol Weight 389.27 g/mol
Molecular Formula C16H13BrN4OS
Exact Mass 387.999345 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KXBKYTemF32
Name 2-{[5-(3-bromophenyl)-4-phenyl-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/C16H13BrN4OS/c17-12-6-4-5-11(9-12)15-19-20-16(23-10-14(18)22)21(15)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,22)
InChIKey CKZXTFXCCLDLCB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3606
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: UZI/8096705; UBI_ID: UBI-003607
Temperature 308 °C