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2-(4-acetoxy-3-ethoxybenzylidene)-1-(4-amino-3-methyl-1H-1,2,4-triazol-5(4H)-ylidene)hydrazin-1-ium chloride
SpectraBase Compound ID HNjZ2VCO1Kq
InChI InChI=1S/C14H19N6O3.ClH/c1-4-22-13-7-11(5-6-12(13)23-10(3)21)8-16-18-14-19-17-9(2)20(14)15;/h5-8,18-19H,4,15H2,1-3H3;1H/q+1;/p-1/b16-8+;
InChIKey VDFQDLQBROJKIS-OHGISNTKSA-M
Mol Weight 354.8 g/mol
Molecular Formula C14H19ClN6O3
Exact Mass 354.120716 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dgm8CjQPSu0
Name 2-(4-acetoxy-3-ethoxybenzylidene)-1-(4-amino-3-methyl-1H-1,2,4-triazol-5(4H)-ylidene)hydrazin-1-ium chloride
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/C14H19N6O3.ClH/c1-4-22-13-7-11(5-6-12(13)23-10(3)21)8-16-18-14-19-17-9(2)20(14)15;/h5-8,18-19H,4,15H2,1-3H3;1H/q+1;/p-1/b16-8+;
InChIKey VDFQDLQBROJKIS-OHGISNTKSA-M
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7227
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: SADD/5681108; IOH_ID: IOH-014231