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(S)-4-Benzylsulfanyl-4-phenyl-butan-2-one
SpectraBase Compound ID EwdfsU7eqLa
InChI InChI=1S/C17H18OS/c1-14(18)12-17(16-10-6-3-7-11-16)19-13-15-8-4-2-5-9-15/h2-11,17H,12-13H2,1H3/t17-/m0/s1
InChIKey PAGXYHLNBKAPOK-KRWDZBQOSA-N
Mol Weight 270.39 g/mol
Molecular Formula C17H18OS
Exact Mass 270.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJNMdytPpa7
Name (S)-4-Benzylsulfanyl-4-phenyl-butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18OS
InChI InChI=1S/C17H18OS/c1-14(18)12-17(16-10-6-3-7-11-16)19-13-15-8-4-2-5-9-15/h2-11,17H,12-13H2,1H3/t17-/m0/s1
InChIKey PAGXYHLNBKAPOK-KRWDZBQOSA-N
Literature Reference DOI 10.1021/ol200379r
Molecular Weight 270.390 g/mol
SMILES c1cc(ccc1)[C@](CC(C)=O)(SCc1ccccc1)[H]
SPLASH splash10-0006-9200000000-56df71cc117bfa3a2b21
Source of Spectrum A1-13-2150/SMS4-4
Synonyms (S)-4-(benzylthio)-4-phenylbutan-2-one
Wiley ID 1753119