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3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-phenyl-4-[2-(1H-pyrazol-5-yl)diazenyl]-
SpectraBase Compound ID Hs8DeQfz7yA
InChI InChI=1S/C13H12N6O/c1-9-12(17-16-11-7-8-14-15-11)13(20)19(18-9)10-5-3-2-4-6-10/h2-8,12H,1H3,(H,14,15)/b17-16+
InChIKey PTCIORUXNMZVQN-WUKNDPDISA-N
Mol Weight 268.28 g/mol
Molecular Formula C13H12N6O
Exact Mass 268.107259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbTxcepH9gg
Name 3H-pyrazol-3-one, 2,4-dihydro-5-methyl-2-phenyl-4-[2-(1H-pyrazol-5-yl)diazenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N6O
InChI InChI=1S/C13H12N6O/c1-9-12(17-16-11-7-8-14-15-11)13(20)19(18-9)10-5-3-2-4-6-10/h2-8,12H,1H3,(H,14,15)/b17-16+
InChIKey PTCIORUXNMZVQN-WUKNDPDISA-N
Molecular Weight 268.280 g/mol
SMILES [nH]1nccc1\N=N\C1C(C)=NN(C1=O)c1ccccc1
SPLASH splash10-014i-9340000000-6cb09cf727ea03fb17d1
Source of Spectrum JX-2015-2-430
Synonyms (E)-4-((1H-pyrazol-5-yl)diazenyl)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
Wiley ID 1722158