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(+/-)-Hexyl 2-oxocyclopentanecarboxylate
SpectraBase Compound ID 4OaZpA2rrNC
InChI InChI=1S/C12H20O3/c1-2-3-4-5-9-15-12(14)10-7-6-8-11(10)13/h10H,2-9H2,1H3
InChIKey NNQVRTQWNFNRND-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 AO3SkKQwzCX
Name (+/-)-Hexyl 2-oxocyclopentanecarboxylate
Alternate Name(s) Hexyl 2-oxocyclopentanecarboxylate 2-Oxo-1-cyclopentanecarboxylic acid hexyl ester Hexyl 2-oxocyclopentane-1-carboxylate Hexyl 2-oxidanylidenecyclopentane-1-carboxylate
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-2-3-4-5-9-15-12(14)10-7-6-8-11(10)13/h10H,2-9H2,1H3
InChIKey NNQVRTQWNFNRND-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.3182
Molecular Weight 212.289 g/mol
SMILES C1(C(CCC1)=O)C(=O)OCCCCCC
SPLASH splash10-03dl-7900000000-a882350d5345daa364e1
Source of Spectrum FF-29-81-33
Wiley ID 1775672