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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 5DtGRwF7sGt
InChI InChI=1S/C22H23N9O4/c1-30(15-7-5-4-6-8-15)13-16-19(25-29-31(16)21-20(23)27-35-28-21)22(32)26-24-12-14-9-10-17(33-2)18(11-14)34-3/h4-12H,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+
InChIKey SEJMMRAYVRVEEJ-WYMPLXKRSA-N
Mol Weight 477.49 g/mol
Molecular Formula C22H23N9O4
Exact Mass 477.1873 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F9y09IaaCve
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)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/C22H23N9O4/c1-30(15-7-5-4-6-8-15)13-16-19(25-29-31(16)21-20(23)27-35-28-21)22(32)26-24-12-14-9-10-17(33-2)18(11-14)34-3/h4-12H,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+
InChIKey SEJMMRAYVRVEEJ-WYMPLXKRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8483
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: E12218; Labnumber: MROZ-1262; SBI_ID: SBI-008486
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3,4-dimethoxyphenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C