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3-(2-Phenylethynyl)-2-phenylphenanthrene-1,4-quinone
SpectraBase Compound ID Cx4jCB1xdiV
InChI InChI=1S/C28H16O2/c29-27-24-18-16-20-11-7-8-14-22(20)26(24)28(30)23(17-15-19-9-3-1-4-10-19)25(27)21-12-5-2-6-13-21/h1-14,16,18H
InChIKey YOMJOCHOGCQXAL-UHFFFAOYSA-N
Mol Weight 384.43 g/mol
Molecular Formula C28H16O2
Exact Mass 384.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1axGhpACYBm
Name 3-(2-Phenylethynyl)-2-phenylphenanthrene-1,4-quinone
Alternate Name(s) 2-Phenyl-3-(phenylethynyl)-1,4-phenanthrenedione 3-(2-Phenylethynyl)-2-phenylylphenanthrene-1,4-quinone
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Formula C28H16O2
InChI InChI=1S/C28H16O2/c29-27-24-18-16-20-11-7-8-14-22(20)26(24)28(30)23(17-15-19-9-3-1-4-10-19)25(27)21-12-5-2-6-13-21/h1-14,16,18H
InChIKey YOMJOCHOGCQXAL-UHFFFAOYSA-N
Molecular Weight 384.434 g/mol
SMILES C=1(C(c2c3c(cccc3)ccc2C(C1c1ccccc1)=O)=O)C#Cc1ccccc1
SPLASH splash10-003r-0209000000-f3030be450a8398919db
Source of Spectrum C-118-2177-21
Wiley ID 759638