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2-[(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)(4-methylphenyl)methyl]malononitrile
SpectraBase Compound ID H89Ctq1XhkI
InChI InChI=1S/C15H14N4O/c1-9-3-5-11(6-4-9)14(12(7-16)8-17)13-10(2)18-19-15(13)20/h3-6,12-14H,1-2H3,(H,19,20)
InChIKey MRIPGWVVTBYFNU-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C15H14N4O
Exact Mass 266.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ukXd5YuNy3
Name 2-[(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)(4-methylphenyl)methyl]malononitrile
Alternate Name(s) 2-[(3-keto-5-methyl-2-pyrazolin-4-yl)-(p-tolyl)methyl]malononitrile 2-[(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile 2-[(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile 2-[(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)-(p-tolyl)methyl]propanedinitrile Propanedinitrile, 2-(3-methyl-5-oxo-2-pyrazolin-4-yl)(4-methylphenyl)methyl-
CAS Registry Number 82805-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N4O
InChI InChI=1S/C15H14N4O/c1-9-3-5-11(6-4-9)14(12(7-16)8-17)13-10(2)18-19-15(13)20/h3-6,12-14H,1-2H3,(H,19,20)
InChIKey MRIPGWVVTBYFNU-UHFFFAOYSA-N
Molecular Weight 266.304 g/mol
SMILES N1N=C(C(C1=O)C(C(C#N)C#N)c1ccc(cc1)C)C
SPLASH splash10-0udi-7950000000-d6d3f946408ffddb9be2
Source of Spectrum AD-0-2532-0
Wiley ID 1422592