| SpectraBase Spectrum ID |
1ve8SaylkOl |
| Name |
1,2,16,17-Tetrahexyl[2.1.2.1]paracyclophane-1,16-diene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C54H72 |
| InChI |
InChI=1S/C54H72/c1-5-9-13-17-21-51-47-33-25-43(26-34-47)41-45-29-37-49(38-30-45)53(23-19-15-11-7-3)54(24-20-16-12-8-4)50-39-31-46(32-40-50)42-44-27-35-48(36-28-44)52(51)22-18-14-10-6-2/h25-40H,5-24,41-42H2,1-4H3/b52-51-,54-53- |
| InChIKey |
VCIXVOSFEUSQKN-IJNHWBTQSA-N |
| Molecular Weight |
721.170 g/mol |
| SMILES |
c12\C(=C/(c3ccc(Cc4ccc(\C(=C/(c5ccc(Cc(cc2)cc1)cc5)CCCCCC)CCCCCC)cc4)cc3)CCCCCC)CCCCCC |
| SPLASH |
splash10-00di-0000000900-1fd0906f002f509a2642 |
| Source of Spectrum |
QF-9-1163-6 |
| Wiley ID |
1558304 |
![1,2,16,17-Tetrahexyl[2.1.2.1]paracyclophane-1,16-diene](/api/spectrum/1ve8SaylkOl/structure.png?h=300&w=458 "1,2,16,17-Tetrahexyl[2.1.2.1]paracyclophane-1,16-diene")
