| SpectraBase Compound ID | DqhtedXSiKx |
|---|---|
| InChI | InChI=1S/C20H26F3NO2/c1-4-6-8-14-17(11-5-2)26-18(16-12-9-7-10-13-16)15(3)24-19(25)20(21,22)23/h5,7-10,12-15,17-18H,2,4,6,11H2,1,3H3,(H,24,25)/b14-8+/t15-,17-,18+/m1/s1 |
| InChIKey | COCCJYSURZUSLO-SDNOTDFQSA-N |
| Mol Weight | 369.43 g/mol |
| Molecular Formula | C20H26F3NO2 |
| Exact Mass | 369.191564 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AZ0EVkhUyRb |
|---|---|
| Name | (4R,1'R,2'R)-4-(2'-Trifluoroacetylamido-1'-phenylpropyloxy)non-1,5-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 369.191563568 u |
| Formula | C20H26F3NO2 |
| InChI | InChI=1S/C20H26F3NO2/c1-4-6-8-14-17(11-5-2)26-18(16-12-9-7-10-13-16)15(3)24-19(25)20(21,22)23/h5,7-10,12-15,17-18H,2,4,6,11H2,1,3H3,(H,24,25)/b14-8+/t15-,17-,18+/m1/s1 |
| InChIKey | COCCJYSURZUSLO-SDNOTDFQSA-N |
| Molecular Weight | 369.428 g/mol |
| SMILES | C(C(N[C@@]([C@](O[C@@](\C=C\CCC)(CC=C)[H])(C1=CC=CC=C1)[H])(C)[H])=O)(F)(F)F |