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(1R,5R)-2-keto-5-(2-ketohexyl)cyclopentane-1-carboxylic acid methyl ester
SpectraBase Compound ID KoHq8q6dQGs
InChI InChI=1S/C13H20O4/c1-3-4-5-10(14)8-9-6-7-11(15)12(9)13(16)17-2/h9,12H,3-8H2,1-2H3/t9-,12-/m1/s1
InChIKey QPCNQLSDHSNPSQ-BXKDBHETSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdzL3nnMUVp
Name (1R,5R)-2-keto-5-(2-ketohexyl)cyclopentanecarboxylic acid methyl ester
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Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-3-4-5-10(14)8-9-6-7-11(15)12(9)13(16)17-2/h9,12H,3-8H2,1-2H3/t9-,12-/m1/s1
InChIKey QPCNQLSDHSNPSQ-BXKDBHETSA-N
Molecular Weight 240.299 g/mol
SMILES [C@@]1([C@@](CC(=O)CCCC)(CCC1=O)[H])(C(=O)OC)[H]
SPLASH splash10-0006-9610000000-3d1b570956639cf7531b
Source of Spectrum K-126-1941-27
Synonyms (1R,5R)-2-oxo-5-(2-oxohexyl)-1-cyclopentanecarboxylic acid methyl ester Methyl (1R,5R)-2-oxidanylidene-5-(2-oxidanylidenehexyl)cyclopentane-1-carboxylate Methyl (1R,5R)-2-oxo-5-(2-oxohexyl)cyclopentane-1-carboxylate Methyl (1R,5R)-2-oxo-5-(2-oxohexyl)cyclopentanecarboxylate
Wiley ID 1242884