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(1S,2R)-2-[(1S)-2-keto-1-methyl-butyl]cyclopentanecarboxylic acid methyl ester
SpectraBase Compound ID DAiTIXVmCQM
InChI InChI=1S/C12H20O3/c1-4-11(13)8(2)9-6-5-7-10(9)12(14)15-3/h8-10H,4-7H2,1-3H3/t8-,9+,10-/m0/s1
InChIKey QUMMFQTXOBXWQV-AEJSXWLSSA-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 7ixBPWGLzH6
Name (1S,2R)-2-[(1S)-2-keto-1-methyl-butyl]cyclopentanecarboxylic acid methyl ester
Alternate Name(s) Methyl (+)-(1S,2R,1'S)-2-( 1'-Methyl-2'-oxobutyl)cyclopentanecarboxylate (1S,2R)-2-[(2S)-3-oxopentan-2-yl]-1-cyclopentanecarboxylic acid methyl ester Methyl (1S,2R)-2-[(1S)-1-methyl-2-oxo-butyl]cyclopentanecarboxylate Methyl (1S,2R)-2-[(2S)-3-oxopentan-2-yl]cyclopentane-1-carboxylate Methyl (1S,2R)-2-[(2S)-3-oxidanylidenepentan-2-yl]cyclopentane-1-carboxylate
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-4-11(13)8(2)9-6-5-7-10(9)12(14)15-3/h8-10H,4-7H2,1-3H3/t8-,9+,10-/m0/s1
InChIKey QUMMFQTXOBXWQV-AEJSXWLSSA-N
Molecular Weight 212.289 g/mol
SMILES [C@@]1([C@@](C(=O)OC)(CCC1)[H])([C@@](C(=O)CC)(C)[H])[H]
SPLASH splash10-0a4r-8900000000-509c36b75ddf2826ff02
Source of Spectrum K-126-1943-31a
Wiley ID 1227633