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3,5-Diketo-4-methyl-2-phenyl-1,2,4-triazine-6-carbonitrile
SpectraBase Compound ID CwhBx3lLHHb
InChI InChI=1S/C11H8N4O2/c1-14-10(16)9(7-12)13-15(11(14)17)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey CKTVVJAKKRSBKS-UHFFFAOYSA-N
Mol Weight 228.21 g/mol
Molecular Formula C11H8N4O2
Exact Mass 228.064726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CObcaduOzKr
Name 3,5-Diketo-4-methyl-2-phenyl-1,2,4-triazine-6-carbonitrile
CAS Registry Number 54994-95-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N4O2
InChI InChI=1S/C11H8N4O2/c1-14-10(16)9(7-12)13-15(11(14)17)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey CKTVVJAKKRSBKS-UHFFFAOYSA-N
Molecular Weight 228.211 g/mol
SMILES C1(N(C(C(=NN1c1ccccc1)C#N)=O)C)=O
SPLASH splash10-002f-9440000000-c835ee7a160247b5916a
Source of Spectrum H-61-1181-0
Synonyms 4-Methyl-3,5-bis(oxidanylidene)-2-phenyl-1,2,4-triazine-6-carbonitrile 4-Methyl-3,5-dioxo-2-phenyl-1,2,4-triazine-6-carbonitrile
Wiley ID 1229306