| SpectraBase Spectrum ID |
AkaJplNqTr9 |
| Name |
2,3,6,7,10,11-Hexakis[(E)-3',3'-dimethyl-1'-butenyl]triphenylene |
| Alternate Name(s) |
2,3,6,7,10,11-hexakis[(1E)-3,3-dimethyl-1-butenyl]triphenylene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C54H72 |
| InChI |
InChI=1S/C54H72/c1-49(2,3)25-19-37-31-43-44(32-38(37)20-26-50(4,5)6)46-34-40(22-28-52(10,11)12)42(24-30-54(16,17)18)36-48(46)47-35-41(23-29-53(13,14)15)39(33-45(43)47)21-27-51(7,8)9/h19-36H,1-18H3/b25-19+,26-20+,27-21+,28-22+,29-23+,30-24+ |
| InChIKey |
JKWRYVAAONMGDT-LQURRZMYSA-N |
| Molecular Weight |
721.170 g/mol |
| SMILES |
c12c3c(cc(c(c3)\C=C\C(C)(C)C)\C=C\C(C)(C)C)c3c(c1cc(c(c2)\C=C\C(C)(C)C)\C=C\C(C)(C)C)cc(c(\C=C\C(C)(C)C)c3)\C=C\C(C)(C)C |
| SPLASH |
splash10-00di-0001000900-d0bd5b04cd2f7af01839 |
| Source of Spectrum |
QE-11-318-25 |
| Wiley ID |
1586507 |
![2,3,6,7,10,11-Hexakis[(E)-3',3'-dimethyl-1'-butenyl]triphenylene](/api/spectrum/AkaJplNqTr9/structure.png?h=300&w=458 "2,3,6,7,10,11-Hexakis[(E)-3',3'-dimethyl-1'-butenyl]triphenylene")
