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1-Phenyl-4-phenylthiomethylpent-4-en-1-one
SpectraBase Compound ID EJtPc8Or6iQ
InChI InChI=1S/C18H18OS/c1-15(14-20-17-10-6-3-7-11-17)12-13-18(19)16-8-4-2-5-9-16/h2-11H,1,12-14H2
InChIKey FWGAEOFFIABSGF-UHFFFAOYSA-N
Mol Weight 282.4 g/mol
Molecular Formula C18H18OS
Exact Mass 282.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BlseXUxIFT
Name 1-Phenyl-4-phenylthiomethylpent-4-en-1-one
Alternate Name(s) 1-Phenyl-4-[(phenylsulfanyl)methyl]-4-penten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18OS
InChI InChI=1S/C18H18OS/c1-15(14-20-17-10-6-3-7-11-17)12-13-18(19)16-8-4-2-5-9-16/h2-11H,1,12-14H2
InChIKey FWGAEOFFIABSGF-UHFFFAOYSA-N
Molecular Weight 282.401 g/mol
SMILES C(=O)(CCC(=C)CSc1ccccc1)c1ccccc1
SPLASH splash10-0ae9-4930000000-d738666101799d527109
Source of Spectrum F-50-9373-0
Wiley ID 1286221