SpectraBase Spectrum ID |
B3Ix5ZZNPRw |
Name |
4-Iodo-3"'-bromo-1-[4-(4-phenyl-3,6-dihexylphenyl)phenyl]benzene dimer |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C72H80BrI |
InChI |
InChI=1S/C72H80BrI/c1-5-9-13-17-23-63-50-70(58-41-35-55(36-42-58)62-29-22-30-67(73)48-62)64(24-18-14-10-6-2)49-69(63)56-37-31-53(32-38-56)60-27-21-28-61(47-60)54-33-39-57(40-34-54)71-51-66(26-20-16-12-8-4)72(59-43-45-68(74)46-44-59)52-65(71)25-19-15-11-7-3/h21-22,27-52H,5-20,23-26H2,1-4H3 |
InChIKey |
XWROGJDVYUJUOP-UHFFFAOYSA-N |
Molecular Weight |
1152.240 g/mol |
SMILES |
c1(cc(CCCCCC)c(cc1CCCCCC)-c1ccc(-c2cc(Br)ccc2)cc1)-c1ccc(-c2cc(-c3ccc(-c4cc(CCCCCC)c(cc4CCCCCC)-c4ccc(cc4)I)cc3)ccc2)cc1 |
SPLASH |
splash10-0udi-0900000000-967afdd8399972a901d3 |
Source of Spectrum |
QE-5-427-11 |
Synonyms |
4-Iodo-3'''-bromo-1'''-[4-(4-phenyl-3,6-dihexylphenyl)phenyl]benzene dimer |
Wiley ID |
844075 |