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(5S)-6-Acetoxy-5-methyl-1-phenylhexan-3-one
SpectraBase Compound ID 1uH3bELZjdt
InChI InChI=1S/C15H20O3/c1-12(11-18-13(2)16)10-15(17)9-8-14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3/t12-/m0/s1
InChIKey GQXJKEOETZXZMR-LBPRGKRZSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JU7tKB3qHqK
Name (5S)-6-Acetoxy-5-methyl-1-phenylhexan-3-one
Alternate Name(s) Acetic acid[(2S)-2-methyl-4-oxo-6-phenylhexyl]ester Acetic acid[(2S)-4-keto-2-methyl-6-phenyl-hexyl]ester [(2S)-2-methyl-4-oxidanylidene-6-phenyl-hexyl]ethanoate [(2S)-2-methyl-4-oxo-6-phenyl-hexyl]acetate Acetic acid [(2S)-2-methyl-4-oxo-6-phenylhexyl] ester [(2S)-2-methyl-4-oxo-6-phenylhexyl] acetate [(2S)-2-methyl-4-oxo-6-phenyl-hexyl] acetate [(2S)-2-methyl-4-oxidanylidene-6-phenyl-hexyl] ethanoate
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Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-12(11-18-13(2)16)10-15(17)9-8-14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3/t12-/m0/s1
InChIKey GQXJKEOETZXZMR-LBPRGKRZSA-N
Molecular Weight 248.322 g/mol
SMILES C(=O)(OC[C@](CC(=O)CCc1ccccc1)(C)[H])C
SPLASH splash10-000k-0900000000-8327cf843d2675b63d92
Source of Spectrum J-59-3450-2
Wiley ID 1251442