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Ethyl 2-acetyl-5-oxo-3-phenylhexanoate
SpectraBase Compound ID BioYg0CY2t4
InChI InChI=1S/C16H20O4/c1-4-20-16(19)15(12(3)18)14(10-11(2)17)13-8-6-5-7-9-13/h5-9,14-15H,4,10H2,1-3H3
InChIKey LIIJJKUSHIPJEE-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KV6idF6LA2c
Name Ethyl 2-acetyl-5-oxo-3-phenylhexanoate
Alternate Name(s) 2-Acetyl-5-keto-3-phenyl-hexanoic acid ethyl ester 2-Acetyl-5-oxo-3-phenylhexanoic acid ethyl ester Ethyl 2-ethanoyl-5-oxidanylidene-3-phenyl-hexanoate
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Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-4-20-16(19)15(12(3)18)14(10-11(2)17)13-8-6-5-7-9-13/h5-9,14-15H,4,10H2,1-3H3
InChIKey LIIJJKUSHIPJEE-UHFFFAOYSA-N
Molecular Weight 276.332 g/mol
SMILES C(C(CC(=O)C)c1ccccc1)(C(=O)OCC)C(=O)C
SPLASH splash10-001a-0900000000-204748f2a6dcbf554085
Source of Spectrum KC-0-3148-3
Wiley ID 823653