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2-(3-Methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)propanedinitrile
SpectraBase Compound ID AakoYGhsNQL
InChI InChI=1S/C13H8N4O/c1-9-12(10(7-14)8-15)13(18)17(16-9)11-5-3-2-4-6-11/h2-6H,1H3
InChIKey NPEWEFOZEJDDBF-UHFFFAOYSA-N
Mol Weight 236.23 g/mol
Molecular Formula C13H8N4O
Exact Mass 236.069811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvlgO2AlapS
Name 2-(3-Methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)propanedinitrile
Alternate Name(s) 2-(3-Methyl-5-oxo-1-phenyl-4-pyrazolylidene)propanedinitrile 2-(3-Methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)propanedinitrile 2-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)malononitrile
CAS Registry Number 117506-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8N4O
InChI InChI=1S/C13H8N4O/c1-9-12(10(7-14)8-15)13(18)17(16-9)11-5-3-2-4-6-11/h2-6H,1H3
InChIKey NPEWEFOZEJDDBF-UHFFFAOYSA-N
Molecular Weight 236.234 g/mol
SMILES C1(C(C(C)=NN1c1ccccc1)=C(C#N)C#N)=O
SPLASH splash10-000i-0090000000-6ce1129643893c60d625
Source of Spectrum AH-119-1003-2
Wiley ID 1237926