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Methyl 2-oxo-1-( 2',2'-dimethyl-1'-phenylthiopropyl)cyclopentanecarboxylate
SpectraBase Compound ID AjEGJ5pLV0k
InChI InChI=1S/C18H24O3S/c1-17(2,3)15(22-13-9-6-5-7-10-13)18(16(20)21-4)12-8-11-14(18)19/h5-7,9-10,15H,8,11-12H2,1-4H3
InChIKey VOMHAWXKIQKVBD-UHFFFAOYSA-N
Mol Weight 320.45 g/mol
Molecular Formula C18H24O3S
Exact Mass 320.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKIhvbyRlSP
Name Methyl 2-oxo-1-( 2',2'-dimethyl-1'-phenylthiopropyl)cyclopentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O3S
InChI InChI=1S/C18H24O3S/c1-17(2,3)15(22-13-9-6-5-7-10-13)18(16(20)21-4)12-8-11-14(18)19/h5-7,9-10,15H,8,11-12H2,1-4H3
InChIKey VOMHAWXKIQKVBD-UHFFFAOYSA-N
Molecular Weight 320.447 g/mol
SMILES C1(C(Sc2ccccc2)C(C)(C)C)(C(=O)OC)C(=O)CCC1
SPLASH splash10-004i-0900000000-2bd5624ab2a14a61c933
Source of Spectrum U-1994-893-5
Synonyms Methyl 1-[2,2-dimethyl-1-(phenylsulfanyl)propyl]-2-oxocyclopentanecarboxylate
Wiley ID 766007