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2-Dibenzoylmethylene-3,4-diphenyl-3-cyclobuten-1-one
SpectraBase Compound ID KNpaxWGunsE
InChI InChI=1S/C31H20O3/c32-29(23-17-9-3-10-18-23)28(30(33)24-19-11-4-12-20-24)27-25(21-13-5-1-6-14-21)26(31(27)34)22-15-7-2-8-16-22/h1-20H
InChIKey DZYUTTIWZCNEEA-UHFFFAOYSA-N
Mol Weight 440.5 g/mol
Molecular Formula C31H20O3
Exact Mass 440.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NhYTx4Ppqp
Name 2-Dibenzoylmethylene-3,4-diphenyl-3-cyclobuten-1-one
Alternate Name(s) 2-(4-oxo-2,3-diphenyl-2-cyclobuten-1-ylidene)-1,3-diphenyl-1,3-propanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H20O3
InChI InChI=1S/C31H20O3/c32-29(23-17-9-3-10-18-23)28(30(33)24-19-11-4-12-20-24)27-25(21-13-5-1-6-14-21)26(31(27)34)22-15-7-2-8-16-22/h1-20H
InChIKey DZYUTTIWZCNEEA-UHFFFAOYSA-N
Molecular Weight 440.498 g/mol
SMILES C1(C(C(=C1c1ccccc1)c1ccccc1)=C(C(c1ccccc1)=O)C(c1ccccc1)=O)=O
SPLASH splash10-0a4i-2901000000-7cca0f7279e998c5101b
Source of Spectrum SO-0-620-4
Wiley ID 1539483