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4-(1-methyl-2-oxocyclopentyl)butanoic acid ethyl ester
SpectraBase Compound ID 9TqYCiEGSV5
InChI InChI=1S/C12H20O3/c1-3-15-11(14)7-5-9-12(2)8-4-6-10(12)13/h3-9H2,1-2H3
InChIKey FVNOTRMKTPOXSV-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsBxPPpkHog
Name 4-(1-methyl-2-oxocyclopentyl)butanoic acid ethyl ester
Alternate Name(s) 4-(2-keto-1-methyl-cyclopentyl)butyric acid ethyl ester ethyl 4-(1-methyl-2-oxidanylidene-cyclopentyl)butanoate ethyl 4-(1-methyl-2-oxo-cyclopentyl)butanoate
Comments Less than 3 mono-isotopic peaks
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-3-15-11(14)7-5-9-12(2)8-4-6-10(12)13/h3-9H2,1-2H3
InChIKey FVNOTRMKTPOXSV-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES C1(C(=O)CCC1)(CCCC(=O)OCC)C
SPLASH splash10-0002-9020000000-051bf2971ddd739db9f7
Source of Spectrum U-1993-53-6
Wiley ID 764788