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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID HQBVWGEWQdQ
InChI InChI=1S/C16H19N9O4/c1-24(2)8-10-12(19-23-25(10)15-14(17)21-29-22-15)16(27)20-18-7-9-5-4-6-11(28-3)13(9)26/h4-7,26H,8H2,1-3H3,(H2,17,21)(H,20,27)/b18-7+
InChIKey ADEURSIPLMBGKA-CNHKJKLMSA-N
Mol Weight 401.39 g/mol
Molecular Formula C16H19N9O4
Exact Mass 401.156 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4jBaZbwQaEL
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-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/C16H19N9O4/c1-24(2)8-10-12(19-23-25(10)15-14(17)21-29-22-15)16(27)20-18-7-9-5-4-6-11(28-3)13(9)26/h4-7,26H,8H2,1-3H3,(H2,17,21)(H,20,27)/b18-7+
InChIKey ADEURSIPLMBGKA-CNHKJKLMSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23172
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: D37167; Labnumber: NIG1-2214; SBI_ID: SBI-023176
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 313 °C