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2-Cyano-N-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)-3-(4-tolyl)acrylamide
SpectraBase Compound ID J8eFtqpgJLk
InChI InChI=1S/C18H13N5O2/c1-12-6-8-13(9-7-12)10-14(11-19)17(24)21-23-18(25)15-4-2-3-5-16(15)20-22-23/h2-10H,1H3,(H,21,24)
InChIKey BHWLPZHZNZEXGJ-UHFFFAOYSA-N
Mol Weight 331.34 g/mol
Molecular Formula C18H13N5O2
Exact Mass 331.106925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4E3pHEcqxM
Name 2-Cyano-N-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)-3-(4-tolyl)acrylamide
Appearance Beige crystals
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Formula C18H13N5O2
InChI InChI=1S/C18H13N5O2/c1-12-6-8-13(9-7-12)10-14(11-19)17(24)21-23-18(25)15-4-2-3-5-16(15)20-22-23/h2-10H,1H3,(H,21,24)
InChIKey BHWLPZHZNZEXGJ-UHFFFAOYSA-N
Instrument Name Thermo Scientific Focus-DSQII Quadrupole GC-MS
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3452
Molecular Weight 331.335 g/mol
SMILES N(N1C(c2ccccc2N=N1)=O)C(C(=Cc1ccc(cc1)C)C#N)=O
SPLASH splash10-0kai-1940000000-cdb30f8f97c7b1e8f6a1
Source of Spectrum Y-56-811-9a
Wiley ID 1861155