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1,2-diphenylethyl 4-oxopentanoate
SpectraBase Compound ID 3jvEzdHKmll
InChI InChI=1S/C19H20O3/c1-15(20)12-13-19(21)22-18(17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-11,18H,12-14H2,1H3
InChIKey GWPXPWJIFBWIFU-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C19H20O3
Exact Mass 296.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F8D1PKeYa0o
Name 1,2-diphenylethyl 4-oxopentanoate
Appearance Yellow oil
Carrier Gas Methane
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Exact Mass 296.141244501 u
Formula C19H20O3
InChI InChI=1S/C19H20O3/c1-15(20)12-13-19(21)22-18(17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-11,18H,12-14H2,1H3
InChIKey GWPXPWJIFBWIFU-UHFFFAOYSA-N
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.202201761
Molecular Weight 296.366 g/mol
Quality 222
Reported Formula C19H20O3
SMILES C1(=CC=CC=C1)CC(C1=CC=CC=C1)OC(CCC(C)=O)=O
SPLASH splash10-0006-7910000000-72eeb7cc141586e50785
Source of Spectrum QE-28-SM31-5o (DOI: 10.1002/chem.202201761)
Thin-Layer Chromatography 0.41 (n-pentane/EtOAc, 5:1)
Wiley ID 1900709