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Methyl-{(1R,2R)-1-methyl-2-[(1'SR)-1'-methyl-2'-oxoetyl]-5-oxocyclopent-1-yl}acetate
SpectraBase Compound ID B5Zi3lMA9V5
InChI InChI=1S/C12H18O4/c1-8(7-13)9-4-5-10(14)12(9,2)6-11(15)16-3/h7-9H,4-6H2,1-3H3/t8-,9-,12-/m1/s1
InChIKey IFFVOCGTLQJXIN-KBVBSXBZSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VVAwMxqvbQ
Name Methyl-{(1R,2R)-1-methyl-2-[(1'SR)-1'-methyl-2'-oxoetyl]-5-oxocyclopent-1-yl}acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-8(7-13)9-4-5-10(14)12(9,2)6-11(15)16-3/h7-9H,4-6H2,1-3H3/t8-,9-,12-/m1/s1
InChIKey IFFVOCGTLQJXIN-KBVBSXBZSA-N
Molecular Weight 226.272 g/mol
SMILES [C@@]1([C@](CCC1=O)([C@@](C=O)(C)[H])[H])(CC(=O)OC)C
SPLASH splash10-0a4j-7900000000-e8057899a86e0d5c9572
Source of Spectrum F-70-6726-9
Synonyms Methyl-{(1R,2R)-1-methyl-2-[(1SR)-1-methyl-2-oxoethyl]-5-oxocyclopent-1-yl}acetate Methyl 2-((1R,5R)-1-methyl-2-oxo-5-((S)-1-oxopropan-2-yl)cyclopentyl)acetate
Wiley ID 1743209