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2-Benzoyl-1-(1-naphthyl)-4-phenylbut-2-ene-1,4-dione
SpectraBase Compound ID 525kW2nws1Q
InChI InChI=1S/C27H18O3/c28-25(20-11-3-1-4-12-20)18-24(26(29)21-13-5-2-6-14-21)27(30)23-17-9-15-19-10-7-8-16-22(19)23/h1-18H
InChIKey QWGXAQRMAYYPJA-UHFFFAOYSA-N
Mol Weight 390.44 g/mol
Molecular Formula C27H18O3
Exact Mass 390.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xu4TLRFRvq
Name 2-Benzoyl-1-(1-naphthyl)-4-phenylbut-2-ene-1,4-dione
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H18O3
InChI InChI=1S/C27H18O3/c28-25(20-11-3-1-4-12-20)18-24(26(29)21-13-5-2-6-14-21)27(30)23-17-9-15-19-10-7-8-16-22(19)23/h1-18H
InChIKey QWGXAQRMAYYPJA-UHFFFAOYSA-N
Instrument Name Simadzu GC-MS QP5050
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.176
Molecular Weight 390.438 g/mol
Reported Formula C27H18O3
SMILES c1(ccccc1)C(=O)C(C(=O)c1cccc2c1cccc2)=CC(=O)c1ccccc1
SPLASH splash10-0a6s-0930000000-5302be4c09b1508e23a2
Sample Comments mixture of E/Z (69:31)
Source of Spectrum BJO-13-SM9-4ap
Thin-Layer Chromatography Rf = 0.55 (hexane / EtOAc, 5 :1)
Wiley ID 1848243