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4H-1,2,4-triazole-3-thiol, 4-(2,1,3-benzoxadiazol-4-yl)-5-(4-methoxyphenyl)-

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 4-(2,1,3-benzoxadiazol-4-yl)-5-(4-methoxyphenyl)-
SpectraBase Compound ID Ksa2RvDtZnY
InChI InChI=1S/C15H11N5O2S/c1-21-10-7-5-9(6-8-10)14-16-17-15(23)20(14)12-4-2-3-11-13(12)19-22-18-11/h2-8H,1H3,(H,17,23)
InChIKey WWSKEQLNTYNDQJ-UHFFFAOYSA-N
Mol Weight 325.35 g/mol
Molecular Formula C15H11N5O2S
Exact Mass 325.063346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KHtx4alt4zN
Name 4H-1,2,4-triazole-3-thiol, 4-(2,1,3-benzoxadiazol-4-yl)-5-(4-methoxyphenyl)-
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/C15H11N5O2S/c1-21-10-7-5-9(6-8-10)14-16-17-15(23)20(14)12-4-2-3-11-13(12)19-22-18-11/h2-8H,1H3,(H,17,23)
InChIKey WWSKEQLNTYNDQJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7037
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: F29209; Labnumber: NNOBK-9618