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(S)-4-Cyclopentylsulfanyl-4-phenyl-butan-2-one
SpectraBase Compound ID 6QUIaQh914b
InChI InChI=1S/C15H20OS/c1-12(16)11-15(13-7-3-2-4-8-13)17-14-9-5-6-10-14/h2-4,7-8,14-15H,5-6,9-11H2,1H3/t15-/m0/s1
InChIKey QYKWFQBJRNUJRD-HNNXBMFYSA-N
Mol Weight 248.38 g/mol
Molecular Formula C15H20OS
Exact Mass 248.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeMcFt1sDlP
Name (S)-4-Cyclopentylsulfanyl-4-phenyl-butan-2-one
Alternate Name(s) (S)-4-(cyclopentylthio)-4-phenylbutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20OS
InChI InChI=1S/C15H20OS/c1-12(16)11-15(13-7-3-2-4-8-13)17-14-9-5-6-10-14/h2-4,7-8,14-15H,5-6,9-11H2,1H3/t15-/m0/s1
InChIKey QYKWFQBJRNUJRD-HNNXBMFYSA-N
Literature Reference DOI 10.1021/ol200379r
Molecular Weight 248.384 g/mol
SMILES c1cc(ccc1)[C@@](SC1CCCC1)(CC(C)=O)[H]
SPLASH splash10-0006-9400000000-e331532ff45a60924d35
Source of Spectrum A1-13-2150/SMS5-7
Wiley ID 1753122