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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID LkWEmauaDUk
InChI InChI=1S/C21H21N9O4/c1-29(14-6-4-3-5-7-14)12-15-18(24-28-30(15)20-19(22)26-34-27-20)21(32)25-23-11-13-8-9-16(31)17(10-13)33-2/h3-11,31H,12H2,1-2H3,(H2,22,26)(H,25,32)/b23-11+
InChIKey JQORLDXERAYOST-FOKLQQMPSA-N
Mol Weight 463.46 g/mol
Molecular Formula C21H21N9O4
Exact Mass 463.17165 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JgzEK4mTl4I
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-5-[(methylanilino)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/C21H21N9O4/c1-29(14-6-4-3-5-7-14)12-15-18(24-28-30(15)20-19(22)26-34-27-20)21(32)25-23-11-13-8-9-16(31)17(10-13)33-2/h3-11,31H,12H2,1-2H3,(H2,22,26)(H,25,32)/b23-11+
InChIKey JQORLDXERAYOST-FOKLQQMPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8476
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: E12211; Labnumber: MROZ-1244; SBI_ID: SBI-008479
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C