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Ethyl 2-oxo-3-pentylcyclopentanecarboxylate
SpectraBase Compound ID JcTKR7O9fw9
InChI InChI=1S/C13H22O3/c1-3-5-6-7-10-8-9-11(12(10)14)13(15)16-4-2/h10-11H,3-9H2,1-2H3
InChIKey WHHNCTBVUZUAQF-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3rHwjsXgJ6
Name Ethyl 2-oxo-3-pentylcyclopentanecarboxylate
Alternate Name(s) Ethyl 2-oxo-3-pentylcyclopentane-1-carboxylate
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Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-3-5-6-7-10-8-9-11(12(10)14)13(15)16-4-2/h10-11H,3-9H2,1-2H3
InChIKey WHHNCTBVUZUAQF-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C1(C(C(CC1)CCCCC)=O)C(=O)OCC
SPLASH splash10-03di-4900000000-eff6d9f21981592b35c3
Source of Spectrum Niko Radulovic, et al. Food and Chemical Toxicology, V.50, 2012, P.274-279
Wiley ID 1817140