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1-(4-Anisyl)-3,5-diphenyl-1H-pyrazole
SpectraBase Compound ID JgojSb1Js6u
InChI InChI=1S/C22H18N2O/c1-25-20-14-12-19(13-15-20)24-22(18-10-6-3-7-11-18)16-21(23-24)17-8-4-2-5-9-17/h2-16H,1H3
InChIKey PKVWNAOTHNMNPR-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C22H18N2O
Exact Mass 326.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E78gX32v3cN
Name 1-(4-Anisyl)-3,5-diphenyl-1H-pyrazole
Appearance Yellowish-white solid
Carrier Gas Helium
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Exact Mass 326.141913207 u
Formula C22H18N2O
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C22H18N2O/c1-25-20-14-12-19(13-15-20)24-22(18-10-6-3-7-11-18)16-21(23-24)17-8-4-2-5-9-17/h2-16H,1H3
InChIKey PKVWNAOTHNMNPR-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502995
Molecular Weight 326.399 g/mol
Quality 239
SMILES C1(=NN(C(=C1)C1=CC=CC=C1)C1=CC=C(C=C1)OC)C1=CC=CC=C1
SPLASH splash10-03di-2219000000-4112f7c2df878dbe9507
Source of Spectrum QE-21-SM61-3af (DOI: 10.1002/chem.201502995)
Thin-Layer Chromatography 0.34 (hexane/EtOAc, 10:1)
Wiley ID 1907306