SpectraBase Spectrum ID |
HlVSaS6HYEX |
Name |
5,5"'-Dibromo-3,3'',3''',4,4'',4"'-hexabutyl-2,2':5',2":5",2"':5"',2""-quinquethiophene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C44H58Br2S5 |
InChI |
InChI=1S/C44H58Br2S5/c1-7-13-19-29-31(21-15-9-3)42(43-32(22-16-10-4)30(20-14-8-2)40(50-43)37-27-28-38(45)48-37)49-39(29)35-25-26-36(47-35)41-33(23-17-11-5)34(24-18-12-6)44(46)51-41/h25-28H,7-24H2,1-6H3 |
InChIKey |
ZSJLSULKFGGRHR-UHFFFAOYSA-N |
Molecular Weight |
907.056 g/mol |
SMILES |
c1(-c2sc(-c3sc(-c4sc(Br)c(c4CCCC)CCCC)cc3)c(c2CCCC)CCCC)sc(-c2sc(Br)cc2)c(c1CCCC)CCCC |
SPLASH |
splash10-0a4i-0000000019-f25f08f240448da9a921 |
Source of Spectrum |
KC-57-3790-16 |
Synonyms |
2-{5-[5-(5-bromo-3,4-dibutylthiophen-2-yl)thiophen-2-yl]-3,4-dibutylthiophen-2-yl}-5-(5-bromothiophen-2-yl)-3,4-dibutylthiophene |
Wiley ID |
1623957 |