| SpectraBase Spectrum ID |
2I7PtVqacC |
| Name |
(1S,5R,6R)-Ethyl 5-hydroxy-8-trifluoromethyl-7-oxabicyclo[4.3.0]non-8-ene-9-carboxylate isomer |
| Alternate Name(s) |
Ethyl (3aS,7R,7aR)-7-hydroxy-2-(trifluoromethyl)-3a,4,5,6,7,7a-hexahydro-1-benzofuran-3-carboxylate
Ethyl 5-hydroxy-8-trifluoromethyl-7-oxabicyclo[4.3.0]non-8-ene-9-carboxylate isomer |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15F3O4 |
| InChI |
InChI=1S/C12H15F3O4/c1-2-18-11(17)8-6-4-3-5-7(16)9(6)19-10(8)12(13,14)15/h6-7,9,16H,2-5H2,1H3/t6-,7+,9+/m0/s1 |
| InChIKey |
BMJDWAMLNKVDKL-LKEWCRSYSA-N |
| Molecular Weight |
280.243 g/mol |
| SMILES |
O[C@]1([C@]2([C@](C(=C(O2)C(F)(F)F)C(=O)OCC)(CCC1)[H])[H])[H] |
| SPLASH |
splash10-0076-3900000000-47956bb2c3b42c23df45 |
| Source of Spectrum |
KC-0-2790-4 |
| Wiley ID |
780071 |
![(1S,5R,6R)-Ethyl 5-hydroxy-8-trifluoromethyl-7-oxabicyclo[4.3.0]non-8-ene-9-carboxylate isomer](/api/spectrum/2I7PtVqacC/structure.png?h=300&w=458 "(1S,5R,6R)-Ethyl 5-hydroxy-8-trifluoromethyl-7-oxabicyclo[4.3.0]non-8-ene-9-carboxylate isomer")
