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

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluorophenoxy)methyl]-N'-[(E)-(2-hydroxy-3,5-diiodophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID B57Yq0rJUao
InChI InChI=1S/C19H13FI2N8O4/c20-10-1-3-12(4-2-10)33-8-14-15(25-29-30(14)18-17(23)27-34-28-18)19(32)26-24-7-9-5-11(21)6-13(22)16(9)31/h1-7,31H,8H2,(H2,23,27)(H,26,32)/b24-7+
InChIKey UKRNNFHCTZDSFG-HCBMXOAHSA-N
Mol Weight 690.17 g/mol
Molecular Formula C19H13FI2N8O4
Exact Mass 689.913319 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8uWxcI3ntvD
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluorophenoxy)methyl]-N'-[(E)-(2-hydroxy-3,5-diiodophenyl)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/C19H13FI2N8O4/c20-10-1-3-12(4-2-10)33-8-14-15(25-29-30(14)18-17(23)27-34-28-18)19(32)26-24-7-9-5-11(21)6-13(22)16(9)31/h1-7,31H,8H2,(H2,23,27)(H,26,32)/b24-7+
InChIKey UKRNNFHCTZDSFG-HCBMXOAHSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2801
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: D04592; Labnumber: NIG-2791; SBI_ID: SBI-002803
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluorophenoxy)methyl]-N'-[(2-hydroxy-3,5-diiodophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C