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(E)-1-phenyl-2-phenylthiopent-3-en-1-one
SpectraBase Compound ID 57BfyhkGaOw
InChI InChI=1S/C17H16OS/c1-2-9-16(19-15-12-7-4-8-13-15)17(18)14-10-5-3-6-11-14/h2-13,16H,1H3/b9-2+
InChIKey SPXQMXAWYLCGDK-XNWCZRBMSA-N
Mol Weight 268.37 g/mol
Molecular Formula C17H16OS
Exact Mass 268.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzTWJv30kYy
Name (E)-1-phenyl-2-phenylthiopent-3-en-1-one
Alternate Name(s) (3E)-1-phenyl-2-(phenylsulfanyl)-3-penten-1-one
CAS Registry Number 109328-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16OS
InChI InChI=1S/C17H16OS/c1-2-9-16(19-15-12-7-4-8-13-15)17(18)14-10-5-3-6-11-14/h2-13,16H,1H3/b9-2+
InChIKey SPXQMXAWYLCGDK-XNWCZRBMSA-N
Molecular Weight 268.374 g/mol
SMILES C(C(Sc1ccccc1)\C=C\C)(=O)c1ccccc1
SPLASH splash10-0a4i-2900000000-2a4716ea99ab8cdaa6d0
Source of Spectrum KC-1986-1944-26
Wiley ID 1272463