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Ethyl 2-oxo-1-(1-phenyl-3-oxobutyl)cyclopentanecarboxylate isomer
SpectraBase Compound ID D4FYiHQFXYz
InChI InChI=1S/C18H22O4/c1-3-22-17(21)18(11-7-10-16(18)20)15(12-13(2)19)14-8-5-4-6-9-14/h4-6,8-9,15H,3,7,10-12H2,1-2H3
InChIKey KPWNRTNYSOLQOE-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87BVzmB8vRM
Name Ethyl 2-oxo-1-(1-phenyl-3-oxobutyl)cyclopentanecarboxylate isomer
Alternate Name(s) Ethyl 2-oxo-1-(1-phenyl-3-oxobutyl)cyclopentanecarboxylate Ethyl 2-oxo-1-(3-oxo-1-phenylbutyl)cyclopentanecarboxylate
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Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-3-22-17(21)18(11-7-10-16(18)20)15(12-13(2)19)14-8-5-4-6-9-14/h4-6,8-9,15H,3,7,10-12H2,1-2H3
InChIKey KPWNRTNYSOLQOE-UHFFFAOYSA-N
Molecular Weight 302.370 g/mol
SMILES C1(C(CC(=O)C)c2ccccc2)(C(=O)OCC)C(=O)CCC1
SPLASH splash10-06tr-1970000000-bcfb1aba3a55acfe3e48
Source of Spectrum KC-0-3146-3
Wiley ID 823662