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1,3,5-Pentanethione, 1-(4-methoxyphenyl)-5-phenyl
SpectraBase Compound ID I6QjLzJaXBp
InChI InChI=1S/C18H16O4/c1-22-16-9-7-14(8-10-16)18(21)12-15(19)11-17(20)13-5-3-2-4-6-13/h2-10H,11-12H2,1H3
InChIKey LNAFUYNMMGWAEX-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgA3TtApa1y
Name 1,3,5-Pentanethione, 1-(4-methoxyphenyl)-5-phenyl
Alternate Name(s) 1-(4-Methoxyphenyl)-5-phenyl-1,3,5-pentanetrione 1-(4-Methoxyphenyl)-5-phenyl-pentane-1,3,5-trione
CAS Registry Number 1678-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-22-16-9-7-14(8-10-16)18(21)12-15(19)11-17(20)13-5-3-2-4-6-13/h2-10H,11-12H2,1H3
InChIKey LNAFUYNMMGWAEX-UHFFFAOYSA-N
Molecular Weight 296.322 g/mol
SMILES c1(ccccc1)C(=O)CC(=O)CC(=O)c1ccc(cc1)OC
SPLASH splash10-0550-5910000000-cbb3cede2ece6afeb509
Wiley ID 1477276