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RAC-2-(METHYLTHIO)-ETHYL-2-OXO-1-(3-OXOBUTYL)-CYCLOPENTANE-1-CARBOXYLATE
SpectraBase Compound ID 30Ujj00ZsMN
InChI InChI=1S/C13H20O4S/c1-10(14)5-7-13(6-3-4-11(13)15)12(16)17-8-9-18-2/h3-9H2,1-2H3
InChIKey HMXYQAJJSWECCC-UHFFFAOYSA-N
Mol Weight 272.36 g/mol
Molecular Formula C13H20O4S
Exact Mass 272.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BV6GDpQSPl
Name 2-keto-1-(3-ketobutyl)cyclopentanecarboxylic acid 2-(methylthio)ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4S
InChI InChI=1S/C13H20O4S/c1-10(14)5-7-13(6-3-4-11(13)15)12(16)17-8-9-18-2/h3-9H2,1-2H3
InChIKey HMXYQAJJSWECCC-UHFFFAOYSA-N
Molecular Weight 272.359 g/mol
SMILES C1(C(=O)OCCSC)(C(=O)CCC1)CCC(=O)C
SPLASH splash10-00di-9000000000-5e2bd0e8b68bae61a11e
Source of Spectrum H-2005-5344-0
Synonyms 2-Methylsulfanylethyl 2-oxidanylidene-1-(3-oxidanylidenebutyl)cyclopentane-1-carboxylate 2-Methylsulfanylethyl 2-oxo-1-(3-oxobutyl)cyclopentane-1-carboxylate 2-Oxo-1-(3-oxobutyl)-1-cyclopentanecarboxylic acid 2-(methylthio)ethyl ester
Wiley ID 1588137