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5-((1,3-Diphenyl-1H-pyrazol-4-yl)methylene)-3-phenyl-1,2,4-triazin-6(5H)-one
SpectraBase Compound ID 8F2A6YAAV4Q
InChI InChI=1S/C25H17N5O/c31-25-22(26-24(27-28-25)19-12-6-2-7-13-19)16-20-17-30(21-14-8-3-9-15-21)29-23(20)18-10-4-1-5-11-18/h1-17H
InChIKey JWTCAZIGLPVGDR-UHFFFAOYSA-N
Mol Weight 403.45 g/mol
Molecular Formula C25H17N5O
Exact Mass 403.14331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28oHRfUOo4
Name 5-((1,3-Diphenyl-1H-pyrazol-4-yl)methylene)-3-phenyl-1,2,4-triazin-6(5H)-one
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H17N5O
InChI InChI=1S/C25H17N5O/c31-25-22(26-24(27-28-25)19-12-6-2-7-13-19)16-20-17-30(21-14-8-3-9-15-21)29-23(20)18-10-4-1-5-11-18/h1-17H
InChIKey JWTCAZIGLPVGDR-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2411
Molecular Weight 403.445 g/mol
SMILES c1(ccccc1)-c1n[n](cc1C=C1N=C(N=NC1=O)c1ccccc1)-c1ccccc1
SPLASH splash10-0a4i-9211000000-798bcbe8d62be1cae3a8
Source of Spectrum Y-53-180-6
Wiley ID 1877607