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Cyclopentanebutanoic acid, 2-hydroxy-1-methyl-5-oxo-, methyl ester, cis-(.+-.)-
SpectraBase Compound ID KuGBj0upKd8
InChI InChI=1S/C11H18O4/c1-11(7-3-4-10(14)15-2)8(12)5-6-9(11)13/h8,12H,3-7H2,1-2H3/t8-,11-/m0/s1
InChIKey IOPDYJIXMLNCDV-KWQFWETISA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zGaztMMkQK
Name Cyclopentanebutanoic acid, 2-hydroxy-1-methyl-5-oxo-, methyl ester, cis-(.+-.)-
CAS Registry Number 114647-12-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-11(7-3-4-10(14)15-2)8(12)5-6-9(11)13/h8,12H,3-7H2,1-2H3/t8-,11-/m0/s1
InChIKey IOPDYJIXMLNCDV-KWQFWETISA-N
Molecular Weight 214.261 g/mol
SMILES O[C@@]1([C@@](C(CC1)=O)(CCCC(=O)OC)C)[H]
SPLASH splash10-0002-9720000000-bf6b358e8085af733774
Source of Spectrum KC-1987-2471-9
Synonyms 1-Methyl-1-(3'-methoxycarbonylpronyl)-2-hydroxy-cyclopenta-5-one Methyl 4-[(1S,2S)-2-hydroxy-1-methyl-5-oxocyclopentyl]butanoate
Wiley ID 1213385