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1-(4-Methylsulfanylphenyl)-3-phenylpropan-1-one
SpectraBase Compound ID 50DBLZcsW3k
InChI InChI=1S/C16H16OS/c1-18-15-10-8-14(9-11-15)16(17)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3
InChIKey AQGAYFGXRQFEGI-UHFFFAOYSA-N
Mol Weight 256.36 g/mol
Molecular Formula C16H16OS
Exact Mass 256.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVJLtYjHaSH
Name 1-(4-Methylsulfanylphenyl)-3-phenylpropan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS
InChI InChI=1S/C16H16OS/c1-18-15-10-8-14(9-11-15)16(17)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3
InChIKey AQGAYFGXRQFEGI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol062723e
Molecular Weight 256.363 g/mol
SMILES c1(ccccc1)CCC(c1ccc(cc1)SC)=O
SPLASH splash10-0udi-1940000000-067471ec6ae0275e06d1
Source of Spectrum A1-9-405/SMS12-3i
Synonyms 1-(4-(methylthio)phenyl)-3-phenylpropan-1-one 1-[4-(methylthio)phenyl]-3-phenyl-1-propanone 1-(4-Methylsulfanylphenyl)-3-phenyl-propan-1-one
Wiley ID 1757791