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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-isopropylphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-isopropylphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID E6hPYmrAOQ1
InChI InChI=1S/C21H19N9O4/c1-12(2)14-5-3-13(4-6-14)11-23-25-21(31)17-18(15-7-9-16(10-8-15)30(32)33)29(28-24-17)20-19(22)26-34-27-20/h3-12H,1-2H3,(H2,22,26)(H,25,31)/b23-11+
InChIKey QKFDJGKPFAXGKS-FOKLQQMPSA-N
Mol Weight 461.44 g/mol
Molecular Formula C21H19N9O4
Exact Mass 461.156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LAFCECQUKAP
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-isopropylphenyl)methylidene]-5-(4-nitrophenyl)-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/C21H19N9O4/c1-12(2)14-5-3-13(4-6-14)11-23-25-21(31)17-18(15-7-9-16(10-8-15)30(32)33)29(28-24-17)20-19(22)26-34-27-20/h3-12H,1-2H3,(H2,22,26)(H,25,31)/b23-11+
InChIKey QKFDJGKPFAXGKS-FOKLQQMPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23382
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: D37519; Labnumber: NIG1-3310; SBI_ID: SBI-023386
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(4-isopropylphenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C