| SpectraBase Spectrum ID |
21JDokhf798 |
| Name |
1,2-Di-(2-cyano-5,6;7,8-dibenzo-1,4-dimethylbicyclo[2.2.2]oct-2-enyl)ethyne |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H28N2 |
| InChI |
InChI=1S/C40H28N2/c1-37-25-13-5-9-17-29(25)39(3,30-18-10-6-14-26(30)37)35(23-41)33(37)21-22-34-36(24-42)40(4)31-19-11-7-15-27(31)38(34,2)28-16-8-12-20-32(28)40/h5-20H,1-4H3/t37-,38-,39+,40+ |
| InChIKey |
KHTLQZXDAIWGRA-UHFFFAOYSA-N |
| Molecular Weight |
536.678 g/mol |
| SMILES |
C=1([C@]2(c3ccccc3[C@@](C1C#N)(c1ccccc21)C)C)C#CC=1[C@]2(c3ccccc3[C@@](C1C#N)(c1ccccc21)C)C |
| SPLASH |
splash10-052u-6144090000-13dda37f56633fef3996 |
| Source of Spectrum |
QE-3-1111-10 |
| Wiley ID |
843063 |
![1,2-Di-(2-cyano-5,6;7,8-dibenzo-1,4-dimethylbicyclo[2.2.2]oct-2-enyl)ethyne](/api/spectrum/21JDokhf798/structure.png?h=300&w=458 "1,2-Di-(2-cyano-5,6;7,8-dibenzo-1,4-dimethylbicyclo[2.2.2]oct-2-enyl)ethyne")
