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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 4KWEBRE2OKP
InChI InChI=1S/C19H13N9O6/c20-17-18(25-34-24-17)27-16(11-2-4-12(5-3-11)28(30)31)15(22-26-27)19(29)23-21-8-10-1-6-13-14(7-10)33-9-32-13/h1-8H,9H2,(H2,20,24)(H,23,29)/b21-8+
InChIKey VBKQKJKMIJKVIQ-ODCIPOBUSA-N
Mol Weight 463.37 g/mol
Molecular Formula C19H13N9O6
Exact Mass 463.098879 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2PbW2D9kBhr
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-(4-nitrophenyl)-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/C19H13N9O6/c20-17-18(25-34-24-17)27-16(11-2-4-12(5-3-11)28(30)31)15(22-26-27)19(29)23-21-8-10-1-6-13-14(7-10)33-9-32-13/h1-8H,9H2,(H2,20,24)(H,23,29)/b21-8+
InChIKey VBKQKJKMIJKVIQ-ODCIPOBUSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23193
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: D37197; Labnumber: NIG1-2311; SBI_ID: SBI-023197
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1,3-benzodioxol-5-ylmethylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Temperature 313 °C