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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 9jARlsAamXj
InChI InChI=1S/C17H21N9O5/c1-25(2)8-10-13(20-24-26(10)16-15(18)22-31-23-16)17(28)21-19-7-9-5-11(29-3)14(27)12(6-9)30-4/h5-7,27H,8H2,1-4H3,(H2,18,22)(H,21,28)/b19-7+
InChIKey FGWWCBKCWPNSCB-FBCYGCLPSA-N
Mol Weight 431.41 g/mol
Molecular Formula C17H21N9O5
Exact Mass 431.166565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DgTpsjjPLjP
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)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/C17H21N9O5/c1-25(2)8-10-13(20-24-26(10)16-15(18)22-31-23-16)17(28)21-19-7-9-5-11(29-3)14(27)12(6-9)30-4/h5-7,27H,8H2,1-4H3,(H2,18,22)(H,21,28)/b19-7+
InChIKey FGWWCBKCWPNSCB-FBCYGCLPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23340
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: D37450; Labnumber: NIG1-3058; SBI_ID: SBI-023344
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C