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Cyclopentanethioacetic acid, 2-benzyl-3-oxo-, S-(t-butyl) ester
SpectraBase Compound ID E8vZNCeauvN
InChI InChI=1S/C18H24O2S/c1-18(2,3)21-17(20)12-14-9-10-16(19)15(14)11-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3
InChIKey MFIDYZZIUHIXOI-UHFFFAOYSA-N
Mol Weight 304.45 g/mol
Molecular Formula C18H24O2S
Exact Mass 304.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UMJA4azQqe
Name Cyclopentanethioacetic acid, 2-benzyl-3-oxo-, S-(t-butyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2S
InChI InChI=1S/C18H24O2S/c1-18(2,3)21-17(20)12-14-9-10-16(19)15(14)11-13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3
InChIKey MFIDYZZIUHIXOI-UHFFFAOYSA-N
Molecular Weight 304.448 g/mol
SMILES C1CC(C(C1=O)Cc1ccccc1)CC(=O)SC(C)(C)C
SPLASH splash10-006y-8930000000-f3ff69339bb71aa9e715
Synonyms 2-(2-benzyl-3-keto-cyclopentyl)ethanethioic acid S-tert-butyl ester 2-[3-oxo-2-(phenylmethyl)cyclopentyl]ethanethioic acid S-tert-butyl ester S-(tert-Butyl) (2-benzyl-3-oxocyclopentyl)ethanethioate S-tert-butyl 2-(2-benzyl-3-oxo-cyclopentyl)ethanethioate S-tert-butyl 2-[3-oxidanylidene-2-(phenylmethyl)cyclopentyl]ethanethioate
Wiley ID 1478725