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Dimethyl 3-phenyl-4-(2-phenylethynyl)cyclobut-3-ene-1,2-dicarboxylate
SpectraBase Compound ID KaBUC0vnDHg
InChI InChI=1S/C22H18O4/c1-25-21(23)19-17(14-13-15-9-5-3-6-10-15)18(20(19)22(24)26-2)16-11-7-4-8-12-16/h3-12,19-20H,1-2H3
InChIKey TUPJBQMNXAQBFR-UHFFFAOYSA-N
Mol Weight 346.38 g/mol
Molecular Formula C22H18O4
Exact Mass 346.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIDROH2qxy3
Name Dimethyl 3-phenyl-4-(2-phenylethynyl)cyclobut-3-ene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O4
InChI InChI=1S/C22H18O4/c1-25-21(23)19-17(14-13-15-9-5-3-6-10-15)18(20(19)22(24)26-2)16-11-7-4-8-12-16/h3-12,19-20H,1-2H3
InChIKey TUPJBQMNXAQBFR-UHFFFAOYSA-N
Molecular Weight 346.382 g/mol
SMILES C1(=C(c2ccccc2)C(C1C(=O)OC)C(=O)OC)C#Cc1ccccc1
SPLASH splash10-01ri-0096000000-3572e4c16f8b2085ffa6
Source of Spectrum AT-31-6200-1
Synonyms Dimethyl 3-phenyl-4-(phenylethynyl)-3-cyclobutene-1,2-dicarboxylate
Wiley ID 835842