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1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-, ethyl ester

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1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-, ethyl ester
SpectraBase Compound ID C686DWK37fu
InChI InChI=1S/C14H14N6O3/c1-3-22-14(21)10-11(9-6-4-8(2)5-7-9)20(19-16-10)13-12(15)17-23-18-13/h4-7H,3H2,1-2H3,(H2,15,17)
InChIKey VCKHHZPDSFEYTC-UHFFFAOYSA-N
Mol Weight 314.31 g/mol
Molecular Formula C14H14N6O3
Exact Mass 314.112738 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lspnsn4yaBD
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-, ethyl ester
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/C14H14N6O3/c1-3-22-14(21)10-11(9-6-4-8(2)5-7-9)20(19-16-10)13-12(15)17-23-18-13/h4-7H,3H2,1-2H3,(H2,15,17)
InChIKey VCKHHZPDSFEYTC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_6238
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: NMR/10251032; Labnumber: VUR-0000005
Temperature 303 °C