| SpectraBase Spectrum ID |
B5Pgyk4UBYd |
| Name |
5-Bromo-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 © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H59BrS5 |
| InChI |
InChI=1S/C44H59BrS5/c1-7-13-20-30-32(22-15-9-3)42(48-39(30)36-26-19-29-46-36)43-33(23-16-10-4)31(21-14-8-2)40(49-43)37-27-28-38(47-37)41-34(24-17-11-5)35(25-18-12-6)44(45)50-41/h19,26-29H,7-18,20-25H2,1-6H3 |
| InChIKey |
WCEXOGVUZJCPGM-UHFFFAOYSA-N |
| Molecular Weight |
828.160 g/mol |
| SMILES |
c1(c(c(c(s1)Br)CCCC)CCCC)-c1ccc(s1)-c1c(c(c(s1)-c1c(c(c(s1)-c1cccs1)CCCC)CCCC)CCCC)CCCC |
| SPLASH |
splash10-004i-0000000090-e4564de45493a2c5334a |
| Source of Spectrum |
KC-57-3790-15 |
| Synonyms |
2-[5-(5-bromo-3,4-dibutylthiophen-2-yl)thiophen-2-yl]-3,4-dibutyl-5-[3,4-dibutyl-5-(thiophen-2-yl)thiophen-2-yl]thiophene |
| Wiley ID |
1623958 |
