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1-(4-Amino-furazan-3-yl)-5-phenyl-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 3HjcljRBs1n
InChI InChI=1S/C13H12N6O3/c1-2-21-13(20)9-10(8-6-4-3-5-7-8)19(18-15-9)12-11(14)16-22-17-12/h3-7H,2H2,1H3,(H2,14,16)
InChIKey XZSMHRAGXUUTQP-UHFFFAOYSA-N
Mol Weight 300.28 g/mol
Molecular Formula C13H12N6O3
Exact Mass 300.097088 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JtTcxTblkKZ
Name ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
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/C13H12N6O3/c1-2-21-13(20)9-10(8-6-4-3-5-7-8)19(18-15-9)12-11(14)16-22-17-12/h3-7H,2H2,1H3,(H2,14,16)
InChIKey XZSMHRAGXUUTQP-UHFFFAOYSA-N
NMR Offset 15.8511
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_2449
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: ZI/6071001; Labnumber: PNA-000835; IOH_ID: IOH-002450
Temperature 313 °C