| SpectraBase Spectrum ID |
IOlSWist101 |
| Name |
4-(2'-Hexyn-1'-yl)-13-(1''-oxo-2"-hexyn-1"-yl)-[2.2]paracyclophane |
| Alternate Name(s) |
1-[12-(2-hexynyl)tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl]-2-hexyn-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H30O |
| InChI |
InChI=1S/C28H30O/c1-3-5-7-9-10-26-20-22-12-13-23-15-17-25(19-18-24(26)16-14-22)27(21-23)28(29)11-8-6-4-2/h14-17,20-21H,3-6,10,12-13,18-19H2,1-2H3 |
| InChIKey |
WIVVCUHETCWBJM-UHFFFAOYSA-N |
| Molecular Weight |
382.547 g/mol |
| SMILES |
c1(C(C#CCCC)=O)c2CCc3c(CC#CCCC)cc(CCc(c1)cc2)cc3 |
| SPLASH |
splash10-001r-0900000000-5ca825fe152122f1e0d5 |
| Source of Spectrum |
H-2005-3268-3 |
| Wiley ID |
1563119 |
![4-(2'-Hexyn-1'-yl)-13-(1''-oxo-2"-hexyn-1"-yl)-[2.2]paracyclophane](/api/spectrum/IOlSWist101/structure.png?h=300&w=458 "4-(2'-Hexyn-1'-yl)-13-(1''-oxo-2\"-hexyn-1\"-yl)-[2.2]paracyclophane")
