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Methyl 2-oxo-1-(1'-phenylthiobutyl)cyclopentanecarboxylate
SpectraBase Compound ID 8EImbkxi0nS
InChI InChI=1S/C17H22O3S/c1-3-8-15(21-13-9-5-4-6-10-13)17(16(19)20-2)12-7-11-14(17)18/h4-6,9-10,15H,3,7-8,11-12H2,1-2H3
InChIKey QNFZCRPUCDHGGJ-UHFFFAOYSA-N
Mol Weight 306.42 g/mol
Molecular Formula C17H22O3S
Exact Mass 306.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NuteTM1VA
Name Methyl 2-oxo-1-(1'-phenylthiobutyl)cyclopentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3S
InChI InChI=1S/C17H22O3S/c1-3-8-15(21-13-9-5-4-6-10-13)17(16(19)20-2)12-7-11-14(17)18/h4-6,9-10,15H,3,7-8,11-12H2,1-2H3
InChIKey QNFZCRPUCDHGGJ-UHFFFAOYSA-N
Molecular Weight 306.420 g/mol
SMILES C1(C(CCC1)=O)(C(=O)OC)C(CCC)Sc1ccccc1
SPLASH splash10-0a4j-0905000000-220e917d25108a81781a
Source of Spectrum U-1994-893-5
Synonyms Methyl 2-oxo-1-[1-(phenylsulfanyl)butyl]cyclopentanecarboxylate
Wiley ID 766008