| SpectraBase Compound ID | 66PXE7qDy0I |
|---|---|
| InChI | InChI=1S/C21H27F3O4/c1-13(2)11-12-16(18-17(28-18)14(3)4)27-19(25)20(26-5,21(22,23)24)15-9-7-6-8-10-15/h6-14,16-18H,1-5H3/b12-11-/t16-,17-,18+,20-/m1/s1 |
| InChIKey | WZQRZTWYXBAWIO-MGCCPKTASA-N |
| Mol Weight | 400.44 g/mol |
| Molecular Formula | C21H27F3O4 |
| Exact Mass | 400.186144 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DXundzpVnZ2 |
|---|---|
| Name | WZQRZTWYXBAWIO-MGCCPKTASA-N |
| Compound Number | (S)-MOSHERESTER-OF-#13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H27F3O4 |
| InChI | InChI=1S/C21H27F3O4/c1-13(2)11-12-16(18-17(28-18)14(3)4)27-19(25)20(26-5,21(22,23)24)15-9-7-6-8-10-15/h6-14,16-18H,1-5H3/b12-11-/t16-,17-,18+,20-/m1/s1 |
| InChIKey | WZQRZTWYXBAWIO-MGCCPKTASA-N |
| Literature Reference Author | K.A.PARKER,I.A.KATSOULIS |
| Literature Reference Citation | ORG.LETTERS,6,1413(2004) |
| Literature Reference DOI | 10.1021/ol049735p |
| Solvent | CDCl3 |
| Source File Reference | UWLU50347 |