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4-[(2'-Acetyl-1'-phenyl)-1'-ethenyl)-3-methyl-1-phenyl-4,5-dihydropyrazol-5-one
SpectraBase Compound ID 9AxQtkJOI4c
InChI InChI=1S/C20H18N2O2/c1-14(23)13-18(16-9-5-3-6-10-16)19-15(2)21-22(20(19)24)17-11-7-4-8-12-17/h3-13,19H,1-2H3/b18-13+/t19-/m1/s1
InChIKey JAFBVQPTSLEKCX-HJDVLLJCSA-N
Mol Weight 318.38 g/mol
Molecular Formula C20H18N2O2
Exact Mass 318.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nWjq4Z9QRG
Name 4-[(2'-Acetyl-1'-phenyl)-1'-ethenyl)-3-methyl-1-phenyl-4,5-dihydropyrazol-5-one
Alternate Name(s) (S)-5-Methyl-4-((Z)-3-oxo-1-phenyl-but-1-enyl)-2-phenyl-2,4-dihydro-pyrazol-3-one (4S)-5-methyl-4-[(Z)-3-oxo-1-phenylbut-1-enyl]-2-phenyl-4H-pyrazol-3-one (4S)-5-methyl-4-[(Z)-3-oxo-1-phenyl-but-1-enyl]-2-phenyl-4H-pyrazol-3-one (4S)-5-methyl-4-[(Z)-3-oxidanylidene-1-phenyl-but-1-enyl]-2-phenyl-4H-pyrazol-3-one
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Formula C20H18N2O2
InChI InChI=1S/C20H18N2O2/c1-14(23)13-18(16-9-5-3-6-10-16)19-15(2)21-22(20(19)24)17-11-7-4-8-12-17/h3-13,19H,1-2H3/b18-13+/t19-/m1/s1
InChIKey JAFBVQPTSLEKCX-HJDVLLJCSA-N
Molecular Weight 318.376 g/mol
SMILES C1(N(N=C([C@@]1(\C(=C\C(=O)C)c1ccccc1)[H])C)c1ccccc1)=O
SPLASH splash10-0a4i-9037000000-bb52295dc00c415f47bd
Source of Spectrum SK-31-1341-9
Wiley ID 882031