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1-(4-isopropylphenyl)-3-phenyl-1,3-propanedione
SpectraBase Compound ID CIppO6YX0LG
InChI InChI=1S/C18H18O2/c1-13(2)14-8-10-16(11-9-14)18(20)12-17(19)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3
InChIKey LALVCWMSKLEQMK-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C18H18O2
Exact Mass 266.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eakZuaCLZe
Name 1-(4-isopropylphenyl)-3-phenyl-1,3-propanedione
Alternate Name(s) 1-(4-isopropylphenyl)-3-phenyl-propane-1,3-dione 1-p-cumenyl-3-phenyl-propane-1,3-dione 1-Phenyl-3-(4-propan-2-ylphenyl)propane-1,3-dione
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Formula C18H18O2
InChI InChI=1S/C18H18O2/c1-13(2)14-8-10-16(11-9-14)18(20)12-17(19)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3
InChIKey LALVCWMSKLEQMK-UHFFFAOYSA-N
Molecular Weight 266.340 g/mol
SMILES C(C(c1ccc(cc1)C(C)C)=O)C(=O)c1ccccc1
SPLASH splash10-014j-5950000000-7a5ab0e4c5bba598c740
Source of Spectrum JC-513-323-4
Wiley ID 1270655