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3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-(4-methylphenyl)-4-[(4H-1,2,4-triazol-4-ylamino)methylene]-, (4Z)-
SpectraBase Compound ID J9y0OhuacEO
InChI InChI=1S/C14H14N6O/c1-10-3-5-12(6-4-10)20-14(21)13(11(2)18-20)7-17-19-8-15-16-9-19/h3-9,17H,1-2H3/b13-7-
InChIKey YCFYUSLMLQANGY-QPEQYQDCSA-N
Mol Weight 282.31 g/mol
Molecular Formula C14H14N6O
Exact Mass 282.122909 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F5UBN0txYyk
Name 3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-(4-methylphenyl)-4-[(4H-1,2,4-triazol-4-ylamino)methylene]-, (4Z)-
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/C14H14N6O/c1-10-3-5-12(6-4-10)20-14(21)13(11(2)18-20)7-17-19-8-15-16-9-19/h3-9,17H,1-2H3/b13-7-
InChIKey YCFYUSLMLQANGY-QPEQYQDCSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_160
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: AG-205/5058085; Labnumber: MAR1236; IOH_ID: IOH-007161
Temperature 353 °C