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2-[2-cyclohexyl-1-(4-methoxyphenyl)ethyl]-1-phenyl-butane-1,3-dione
SpectraBase Compound ID 6pFLJxdI7hS
InChI InChI=1S/C25H30O3/c1-18(26)24(25(27)21-11-7-4-8-12-21)23(17-19-9-5-3-6-10-19)20-13-15-22(28-2)16-14-20/h4,7-8,11-16,19,23-24H,3,5-6,9-10,17H2,1-2H3
InChIKey IAFPACJIBPKUNX-UHFFFAOYSA-N
Mol Weight 378.51 g/mol
Molecular Formula C25H30O3
Exact Mass 378.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UgGv9JZuC
Name 2-[2-cyclohexyl-1-(4-methoxyphenyl)ethyl]-1-phenyl-butane-1,3-dione
Appearance Pale yellow oily liquid
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Formula C25H30O3
InChI InChI=1S/C25H30O3/c1-18(26)24(25(27)21-11-7-4-8-12-21)23(17-19-9-5-3-6-10-19)20-13-15-22(28-2)16-14-20/h4,7-8,11-16,19,23-24H,3,5-6,9-10,17H2,1-2H3
InChIKey IAFPACJIBPKUNX-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 378.512 g/mol
Reported Formula C25H31O3
SMILES C1(CC(C(C(=O)C)C(=O)c2ccccc2)c2ccc(cc2)OC)CCCCC1
SPLASH splash10-0079-0928000000-5d3ac35b14d48ef085f8
Sample Comments dr = 1.1:1
Source of Spectrum CN108640839A
Wiley ID 1872470