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1-Phenyl-4-phenylsulfinylmethylpent-4-en-1-one
SpectraBase Compound ID 10u3ad61Efi
InChI InChI=1S/C18H18O2S/c1-15(14-21(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 YCJHPOUFCYPABI-UHFFFAOYSA-N
Mol Weight 298.4 g/mol
Molecular Formula C18H18O2S
Exact Mass 298.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bxo8eGHuAZD
Name 1-Phenyl-4-phenylsulfinylmethylpent-4-en-1-one
Alternate Name(s) 1-Phenyl-4-[(phenylsulfinyl)methyl]-4-penten-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2S
InChI InChI=1S/C18H18O2S/c1-15(14-21(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 YCJHPOUFCYPABI-UHFFFAOYSA-N
Molecular Weight 298.400 g/mol
SMILES C(S(=O)c1ccccc1)C(=C)CCC(=O)c1ccccc1
SPLASH splash10-0a4i-6910000000-46d18f4878512be2aad4
Source of Spectrum F-50-9373-9
Wiley ID 1301054