| SpectraBase Spectrum ID |
E15esd4NZdG |
| Name |
cis,exo-6,11-bis(trifluoromethyl)-1,2,3,4,4a,12b-hexahydro-1,4-methanotriphenylene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H16F6 |
| InChI |
InChI=1S/C21H16F6/c22-20(23,24)12-3-5-14-15-6-4-13(21(25,26)27)9-17(15)19-11-2-1-10(7-11)18(19)16(14)8-12/h3-6,8-11,18-19H,1-2,7H2/t10-,11+,18-,19+ |
| InChIKey |
WKFQAPIKBRAZRF-CYNAHWCSSA-N |
| Molecular Weight |
382.349 g/mol |
| SMILES |
C(F)(F)(F)c1cc2[C@]3([C@]([C@]4(C[C@@]3(CC4)[H])[H])(c3cc(C(F)(F)F)ccc3-c2cc1)[H])[H] |
| SPLASH |
splash10-03di-0019000000-2d7cb26bd85b548c7b10 |
| Source of Spectrum |
CCC-10-SM15-4a |
| Synonyms |
(1R,4S,4aR,12bS)-6,11-bis(trifluoromethyl)-1,2,3,4,4a,12b-hexahydro-1,4-methanotriphenylene |
| Wiley ID |
1812700 |
