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2-{[5-(3-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Kc47SkQpEVn
InChI InChI=1S/C16H13N5O3S/c17-14(22)10-25-16-19-18-15(20(16)12-6-2-1-3-7-12)11-5-4-8-13(9-11)21(23)24/h1-9H,10H2,(H2,17,22)
InChIKey CBUOTNDFYXJJTF-UHFFFAOYSA-N
Mol Weight 355.37 g/mol
Molecular Formula C16H13N5O3S
Exact Mass 355.07391 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CCtd1ksIQ1j
Name 2-{[5-(3-nitrophenyl)-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/C16H13N5O3S/c17-14(22)10-25-16-19-18-15(20(16)12-6-2-1-3-7-12)11-5-4-8-13(9-11)21(23)24/h1-9H,10H2,(H2,17,22)
InChIKey CBUOTNDFYXJJTF-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15914
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/8051721; UBI_ID: UBI-015917
Temperature 308 °C