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(S)-4-Butylsulfanyl-4-phenyl-butan-2-one
SpectraBase Compound ID IvPiq3l5HrC
InChI InChI=1S/C14H20OS/c1-3-4-10-16-14(11-12(2)15)13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3/t14-/m0/s1
InChIKey SZZRYBCJFHCWON-AWEZNQCLSA-N
Mol Weight 236.37 g/mol
Molecular Formula C14H20OS
Exact Mass 236.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8d9QMfg7PrT
Name (S)-4-Butylsulfanyl-4-phenyl-butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20OS
InChI InChI=1S/C14H20OS/c1-3-4-10-16-14(11-12(2)15)13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3/t14-/m0/s1
InChIKey SZZRYBCJFHCWON-AWEZNQCLSA-N
Literature Reference DOI 10.1021/ol200379r
Molecular Weight 236.373 g/mol
SMILES c1cc(ccc1)[C@](CC(C)=O)(SCCCC)[H]
SPLASH splash10-0006-9310000000-0aeb17a29b1015b79c94
Source of Spectrum A1-13-2150/SMS4-5
Synonyms (S)-4-(butylthio)-4-phenylbutan-2-one
Wiley ID 1753120