| SpectraBase Compound ID | 7ecU0kkKtbf |
|---|---|
| InChI | InChI=1S/C21H29F3O5/c1-6-19(27)13(3)16(25)12(2)17(14(19)4)29-18(26)20(28-5,21(22,23)24)15-10-8-7-9-11-15/h7-14,16-17,25,27H,6H2,1-5H3/t12-,13+,14+,16+,17+,19-,20+/m0/s1 |
| InChIKey | ICYTWQZSEMNTJQ-KALJKAKXSA-N |
| Mol Weight | 418.45 g/mol |
| Molecular Formula | C21H29F3O5 |
| Exact Mass | 418.196709 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KtDUnSRT7r7 |
|---|---|
| Name | (S)-MTPA-ESTER-1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H29F3O5 |
| InChI | InChI=1S/C21H29F3O5/c1-6-19(27)13(3)16(25)12(2)17(14(19)4)29-18(26)20(28-5,21(22,23)24)15-10-8-7-9-11-15/h7-14,16-17,25,27H,6H2,1-5H3/t12-,13+,14+,16+,17+,19-,20+/m0/s1 |
| InChIKey | ICYTWQZSEMNTJQ-KALJKAKXSA-N |
| Literature Reference Author | M.TURKS,M.C.MURCIA,R.SCOPELLITI,P.VOGEL |
| Literature Reference Citation | ORG.LETTERS,6,3031(2004) |
| Literature Reference DOI | 10.1021/ol048988f |
| Solvent | CDCl3 |
| Source File Reference | UWSI34484 |