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2-(3-Oxo-2-pentylcyclopentyl)thiopropionic acid, S-t-butyl ester
SpectraBase Compound ID 3tT1vLAv8Hm
InChI InChI=1S/C17H30O2S/c1-6-7-8-9-14-13(10-11-15(14)18)12(2)16(19)20-17(3,4)5/h12-14H,6-11H2,1-5H3
InChIKey KCCJOAGSTDQKTF-UHFFFAOYSA-N
Mol Weight 298.49 g/mol
Molecular Formula C17H30O2S
Exact Mass 298.196651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Ec0kGAHwuX
Name 2-(3-Oxo-2-pentylcyclopentyl)thiopropionic acid, S-t-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O2S
InChI InChI=1S/C17H30O2S/c1-6-7-8-9-14-13(10-11-15(14)18)12(2)16(19)20-17(3,4)5/h12-14H,6-11H2,1-5H3
InChIKey KCCJOAGSTDQKTF-UHFFFAOYSA-N
Molecular Weight 298.485 g/mol
SMILES C(CCC1C(CCC1=O)C(C)C(=O)SC(C)(C)C)CC
SPLASH splash10-0bu0-9810000000-de08b6a9ef4a101c88b0
Synonyms 2-(2-amyl-3-keto-cyclopentyl)propanethioic acid S-tert-butyl ester 2-(3-oxo-2-pentylcyclopentyl)propanethioic acid S-tert-butyl ester S-tert-butyl 2-(3-oxidanylidene-2-pentyl-cyclopentyl)propanethioate S-tert-butyl 2-(3-oxo-2-pentyl-cyclopentyl)propanethioate
Wiley ID 1481651