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4-(4-benzoyl-2-(4-methoxyphenyl)-5-phenylfuran-3-yl)benzonitrile
SpectraBase Compound ID DD5205BEfNh
InChI InChI=1S/C31H21NO3/c1-34-26-18-16-25(17-19-26)30-27(22-14-12-21(20-32)13-15-22)28(29(33)23-8-4-2-5-9-23)31(35-30)24-10-6-3-7-11-24/h2-19H,1H3
InChIKey IZBPJRRFIWIQGH-UHFFFAOYSA-N
Mol Weight 455.51 g/mol
Molecular Formula C31H21NO3
Exact Mass 455.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ylJ9QJgC0A
Name 4-(4-benzoyl-2-(4-methoxyphenyl)-5-phenylfuran-3-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H21NO3
InChI InChI=1S/C31H21NO3/c1-34-26-18-16-25(17-19-26)30-27(22-14-12-21(20-32)13-15-22)28(29(33)23-8-4-2-5-9-23)31(35-30)24-10-6-3-7-11-24/h2-19H,1H3
InChIKey IZBPJRRFIWIQGH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol101080q
Molecular Weight 455.513 g/mol
SMILES c1(-c2ccc(C#N)cc2)c(oc(-c2ccccc2)c1C(=O)c1ccccc1)-c1ccc(cc1)OC
SPLASH splash10-0a4i-1200900000-50dc9abddb490f45069c
Source of Spectrum A1-12-3066/SMS12-1de
Wiley ID 1752295