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Urea, (6-cyano-3,4-dihydro-4-methyl-3-oxo-2-phenyl-1,3,5-triazin-5(2H)-ylidene)phenyl-
SpectraBase Compound ID 7m7eSxKCpat
InChI InChI=1S/C18H14N6O2/c1-23-16(21-17(25)20-13-8-4-2-5-9-13)15(12-19)22-24(18(23)26)14-10-6-3-7-11-14/h2-11H,1H3,(H,20,25)/b21-16+
InChIKey TUTHAXLHLQAUDE-LTGZKZEYSA-N
Mol Weight 346.35 g/mol
Molecular Formula C18H14N6O2
Exact Mass 346.117824 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSK8dt6khe8
Name Urea, (6-cyano-3,4-dihydro-4-methyl-3-oxo-2-phenyl-1,3,5-triazin-5(2H)-ylidene)phenyl-
Alternate Name(s) 2-Phenyl-3-oxo-4-methyl-5-((phenylcarbamyl)imino)-6-cyano-2,3,4,5-tetrahydro-1,2,4-triazine N-((5E)-6-cyano-4-methyl-3-oxo-2-phenyl-3,4-dihydro-1,2,4-triazin-5(2H)-ylidene)-N'-phenylurea
CAS Registry Number 66707-19-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N6O2
InChI InChI=1S/C18H14N6O2/c1-23-16(21-17(25)20-13-8-4-2-5-9-13)15(12-19)22-24(18(23)26)14-10-6-3-7-11-14/h2-11H,1H3,(H,20,25)/b21-16+
InChIKey TUTHAXLHLQAUDE-LTGZKZEYSA-N
Molecular Weight 346.350 g/mol
SMILES N(C(\N=C/1N(C(N(c2ccccc2)N=C1C#N)=O)C)=O)c1ccccc1
SPLASH splash10-004i-9330000000-3aba31d84d0b00fd7a2e
Source of Spectrum H-61-1185-0
Wiley ID 1339124