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(E,E)-1,4-Di(4-(2-(2-thienyl)ethenyl)phenyl)-1,3-butadiyne
SpectraBase Compound ID Ll0ZFsktQq3
InChI InChI=1S/C28H18S2/c1(5-23-9-13-25(14-10-23)17-19-27-7-3-21-29-27)2-6-24-11-15-26(16-12-24)18-20-28-8-4-22-30-28/h3-4,7-22H/b19-17+,20-18+
InChIKey MGGGSZVDKOTDNI-XPWSMXQVSA-N
Mol Weight 418.57 g/mol
Molecular Formula C28H18S2
Exact Mass 418.084993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4otggK7YYRa
Name (E,E)-1,4-Di(4-(2-(2-thienyl)ethenyl)phenyl)-1,3-butadiyne
Comments Less than 3 mono-isotopic peaks
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Formula C28H18S2
InChI InChI=1S/C28H18S2/c1(5-23-9-13-25(14-10-23)17-19-27-7-3-21-29-27)2-6-24-11-15-26(16-12-24)18-20-28-8-4-22-30-28/h3-4,7-22H/b19-17+,20-18+
InChIKey MGGGSZVDKOTDNI-XPWSMXQVSA-N
Molecular Weight 418.572 g/mol
SMILES C(#CC#Cc1ccc(cc1)\C=C\c1cccs1)c1ccc(cc1)\C=C\c1cccs1
SPLASH splash10-014i-0000900000-39baa5e86eda6be5982a
Source of Spectrum F-62-3120-14
Synonyms 2-{(E)-2-[4-(4-{4-[(E)-2-(2-thienyl)ethenyl]phenyl}-1,3-butadiynyl)phenyl]ethenyl}thiophene
Wiley ID 1632796