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2-[3-Styryl-1-phenyl-5-oxo-pyrazol-4-yl]-perimidine
SpectraBase Compound ID F3Yp7MKHMrT
InChI InChI=1S/C28H20N4O/c33-28-26(27-29-22-15-7-11-20-12-8-16-23(30-27)25(20)22)24(18-17-19-9-3-1-4-10-19)31-32(28)21-13-5-2-6-14-21/h1-18,29-30H
InChIKey LLULXBHZHCRSLS-UHFFFAOYSA-N
Mol Weight 428.5 g/mol
Molecular Formula C28H20N4O
Exact Mass 428.163711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8I8UfTaU7DM
Name 2-[3-Styryl-1-phenyl-5-oxo-pyrazol-4-yl]-perimidine
Appearance Green solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20N4O
InChI InChI=1S/C28H20N4O/c33-28-26(27-29-22-15-7-11-20-12-8-16-23(30-27)25(20)22)24(18-17-19-9-3-1-4-10-19)31-32(28)21-13-5-2-6-14-21/h1-18,29-30H
InChIKey LLULXBHZHCRSLS-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-Q1000-EX/GCMS 5988-A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2151
Molecular Weight 428.495 g/mol
SMILES N1c2cccc3cccc(NC1=C1C(=NN(C1=O)c1ccccc1)C=Cc1ccccc1)c23
SPLASH splash10-004i-4313900000-3c3ab8b8cfb9b83b0b74
Source of Spectrum Y-53-912-5c
Wiley ID 1876408