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benzoic acid, 4-[(E)-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl]-
SpectraBase Compound ID 8Jif1mEdd1O
InChI InChI=1S/C12H12N4O2/c1-8-14-15-9(2)16(8)13-7-10-3-5-11(6-4-10)12(17)18/h3-7H,1-2H3,(H,17,18)/b13-7+
InChIKey AVCABEZIPUDTIA-NTUHNPAUSA-N
Mol Weight 244.25 g/mol
Molecular Formula C12H12N4O2
Exact Mass 244.096026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8FyUuszxVth
Name benzoic acid, 4-[(E)-[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl]-
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/C12H12N4O2/c1-8-14-15-9(2)16(8)13-7-10-3-5-11(6-4-10)12(17)18/h3-7H,1-2H3,(H,17,18)/b13-7+
InChIKey AVCABEZIPUDTIA-NTUHNPAUSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_4868
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/10248411