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5-Acetyl-3,3'-bis(phenylethynyl)-2,2'-bithiophene
SpectraBase Compound ID CujDSRjLcc4
InChI InChI=1S/C26H16OS2/c1-19(27)24-18-23(15-13-21-10-6-3-7-11-21)26(29-24)25-22(16-17-28-25)14-12-20-8-4-2-5-9-20/h2-11,16-18H,1H3
InChIKey XQVDISMIMJTXTM-UHFFFAOYSA-N
Mol Weight 408.53 g/mol
Molecular Formula C26H16OS2
Exact Mass 408.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FOGVapC1y7
Name 5-Acetyl-3,3'-bis(phenylethynyl)-2,2'-bithiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H16OS2
InChI InChI=1S/C26H16OS2/c1-19(27)24-18-23(15-13-21-10-6-3-7-11-21)26(29-24)25-22(16-17-28-25)14-12-20-8-4-2-5-9-20/h2-11,16-18H,1H3
InChIKey XQVDISMIMJTXTM-UHFFFAOYSA-N
Molecular Weight 408.533 g/mol
SMILES c1(c(cc(s1)C(=O)C)C#Cc1ccccc1)-c1c(ccs1)C#Cc1ccccc1
SPLASH splash10-0a4i-0001900000-61bd0ebc3713b6b3c658
Source of Spectrum SO-0-1030-6
Synonyms 1-[4-(2-phenylethynyl)-5-[3-(2-phenylethynyl)thiophen-2-yl]thiophen-2-yl]ethan-1-one
Wiley ID 874862