| SpectraBase Compound ID | CdBGlL63odJ |
|---|---|
| InChI | InChI=1S/C15H16F5NO3/c1-4-24-15(23)7(5-6(2)3)21-14(22)8-9(16)11(18)13(20)12(19)10(8)17/h6-7H,4-5H2,1-3H3,(H,21,22) |
| InChIKey | MQVHYSVLFCEDNK-UHFFFAOYSA-N |
| Mol Weight | 353.29 g/mol |
| Molecular Formula | C15H16F5NO3 |
| Exact Mass | 353.105034 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9R2JKWve2Dg |
|---|---|
| Name | L-Leucine, N-pentafluorobenzoyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.105034191 u |
| Formula | C15H16F5NO3 |
| InChI | InChI=1S/C15H16F5NO3/c1-4-24-15(23)7(5-6(2)3)21-14(22)8-9(16)11(18)13(20)12(19)10(8)17/h6-7H,4-5H2,1-3H3,(H,21,22) |
| InChIKey | MQVHYSVLFCEDNK-UHFFFAOYSA-N |
| Molecular Weight | 353.289 g/mol |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)C(NC(C(=O)OCC)CC(C)C)=O)F)F |