| SpectraBase Spectrum ID |
FAHxWb1TXsE |
| Name |
(+)-3-(3,5-ditrifluoromethylphenyl)-dicyclopentadiene |
| Alternate Name(s) |
(3aS,4R,7S,7aR)-3-(3,5-bis(trifluoromethyl)phenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14F6 |
| InChI |
InChI=1S/C18H14F6/c19-17(20,21)12-6-11(7-13(8-12)18(22,23)24)15-4-3-14-9-1-2-10(5-9)16(14)15/h1-2,4,6-10,14,16H,3,5H2/t9-,10+,14-,16+/m1/s1 |
| InChIKey |
XRVFQRRMRYKWQY-LCFNMQHZSA-N |
| Literature Reference DOI |
10.1021/ol101531r |
| Molecular Weight |
344.300 g/mol |
| SMILES |
C1=C[C@@]2([H])[C@]3(CC=C([C@]3([C@]1([H])C2)[H])c1cc(cc(c1)C(F)(F)F)C(F)(F)F)[H] |
| SPLASH |
splash10-004i-1090000000-2f97a628a275db943645 |
| Source of Spectrum |
A1-12-3820/SMS4-13c |
| Wiley ID |
1752464 |
