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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 6bJlwM7EyhC
InChI InChI=1S/C19H16N8O4S/c20-17-18(25-31-24-17)27-14(10-32-13-4-2-1-3-5-13)16(22-26-27)19(30)23-21-9-11-6-7-12(28)8-15(11)29/h1-9,28-29H,10H2,(H2,20,24)(H,23,30)/b21-9+
InChIKey SKPPZILRQXXGLL-ZVBGSRNCSA-N
Mol Weight 452.45 g/mol
Molecular Formula C19H16N8O4S
Exact Mass 452.101522 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7HUNGDuGH9j
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
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/C19H16N8O4S/c20-17-18(25-31-24-17)27-14(10-32-13-4-2-1-3-5-13)16(22-26-27)19(30)23-21-9-11-6-7-12(28)8-15(11)29/h1-9,28-29H,10H2,(H2,20,24)(H,23,30)/b21-9+
InChIKey SKPPZILRQXXGLL-ZVBGSRNCSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25163
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: D49288; Labnumber: NIG1-3265; SBI_ID: SBI-025167
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,4-dihydroxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 300 °C