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6-phenyl-3-(4-phenylthiazol-2-yl)-5-(4-trifluoromethyl-phenylazo)-1H-pyridin-2-one
SpectraBase Compound ID 4E1bpmQaXws
InChI InChI=1S/C27H17F3N4OS/c28-27(29,30)19-11-13-20(14-12-19)33-34-22-15-21(25(35)32-24(22)18-9-5-2-6-10-18)26-31-23(16-36-26)17-7-3-1-4-8-17/h1-16H,(H,32,35)
InChIKey DDSQCPJBORSFLI-UHFFFAOYSA-N
Mol Weight 502.52 g/mol
Molecular Formula C27H17F3N4OS
Exact Mass 502.107517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63HFHozSY18
Name 6-phenyl-3-(4-phenylthiazol-2-yl)-5-(4-trifluoromethyl-phenylazo)-1H-pyridin-2-one
Appearance Orange crystals
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Exact Mass 502.107516845 u
Formula C27H17F3N4OS
InChI InChI=1S/C27H17F3N4OS/c28-27(29,30)19-11-13-20(14-12-19)33-34-22-15-21(25(35)32-24(22)18-9-5-2-6-10-18)26-31-23(16-36-26)17-7-3-1-4-8-17/h1-16H,(H,32,35)
InChIKey DDSQCPJBORSFLI-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.jscs.2023.101647
Molecular Weight 502.515 g/mol
Quality 310
SMILES N1C(=C(C=C(C1=O)C=1SC=C(N1)C1=CC=CC=C1)N=NC1=CC=C(C=C1)C(F)(F)F)C1=CC=CC=C1
SPLASH splash10-0udi-1200090000-c000a0d032d48e23cb2b
Source of Spectrum SCS-27-SM18-3j (DOI: 10.1016/j.jscs.2023.101647)
Wiley ID 1911760