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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID XSg9M5zo0W
InChI InChI=1S/C21H19ClN8O5/c1-32-14-8-11(9-15(33-2)18(14)34-3)10-24-26-21(31)16-17(12-6-4-5-7-13(12)22)30(29-25-16)20-19(23)27-35-28-20/h4-10H,1-3H3,(H2,23,27)(H,26,31)/b24-10+
InChIKey UQGMYBSRSVTXIW-YSURURNPSA-N
Mol Weight 498.89 g/mol
Molecular Formula C21H19ClN8O5
Exact Mass 498.116693 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A4uxM34PmgS
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(E)-(3,4,5-trimethoxyphenyl)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/C21H19ClN8O5/c1-32-14-8-11(9-15(33-2)18(14)34-3)10-24-26-21(31)16-17(12-6-4-5-7-13(12)22)30(29-25-16)20-19(23)27-35-28-20/h4-10H,1-3H3,(H2,23,27)(H,26,31)/b24-10+
InChIKey UQGMYBSRSVTXIW-YSURURNPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12223
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: D59412; Labnumber: NIG1-2968; SBI_ID: SBI-012226
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-N'-[(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C