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alpha-Keto-gamma-phenyl-gamma-(2'-oxocyclohexenyl)-methylbutyrate
SpectraBase Compound ID ERCci2QYXrS
InChI InChI=1S/C17H20O4/c1-21-17(20)16(19)11-14(12-7-3-2-4-8-12)13-9-5-6-10-15(13)18/h2-4,7-8,13-14H,5-6,9-11H2,1H3
InChIKey MBDVAPGXBAKAOX-UHFFFAOYSA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nl8s2yQKhY
Name alpha-Keto-gamma-phenyl-gamma-(2'-oxocyclohexenyl)-methylbutyrate
Alternate Name(s) Methyl 2-oxo-4-(2-oxocyclohexyl)-4-phenylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-21-17(20)16(19)11-14(12-7-3-2-4-8-12)13-9-5-6-10-15(13)18/h2-4,7-8,13-14H,5-6,9-11H2,1H3
InChIKey MBDVAPGXBAKAOX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19863190805
Molecular Weight 288.343 g/mol
SMILES C1CCC(C(C1)C(CC(C(=O)OC)=O)c1ccccc1)=O
SPLASH splash10-0059-4690000000-eb4306c1c177a50407cd
Source of Spectrum APC-319-701-15
Wiley ID 1788299