| SpectraBase Spectrum ID |
CPv7RNihCj4 |
| Name |
Benzocentro-hexaquinane |
| Alternate Name(s) |
Heptacyclo[9.5.2.2(8,14).1(1,8).0(2,7).0(11,21).0(14,21)]henicosa-2(7),3,5-triene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24 |
| InChI |
InChI=1S/C21H24/c1-2-4-16-15(3-1)19-11-7-17-5-6-18(8-12-19)10-14-20(16,13-9-17)21(17,18)19/h1-4H,5-14H2/t17-,18+,19-,20+,21- |
| InChIKey |
WCLWMLAKJLYXRE-CZLMFIFXSA-N |
| Molecular Weight |
276.423 g/mol |
| SMILES |
C123[C@]45c6ccccc6[C@]33CC[C@@]1(CC5)CC[C@@]2(CC4)CC3 |
| SPLASH |
splash10-004i-0190000000-5be5d54c1b0c42548221 |
| Source of Spectrum |
U-1996-1358-11 |
| Wiley ID |
768603 |
