| SpectraBase Compound ID | BZvK86Jt1HI |
|---|---|
| InChI | InChI=1S/C13H22F3NO3/c1-5-6-9(4)20-11(18)10(7-8(2)3)17-12(19)13(14,15)16/h8-10H,5-7H2,1-4H3,(H,17,19) |
| InChIKey | KDZVUPCXIDZBSA-UHFFFAOYSA-N |
| Mol Weight | 297.32 g/mol |
| Molecular Formula | C13H22F3NO3 |
| Exact Mass | 297.155178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L8xIUqHoi1q |
|---|---|
| Name | L-Leucine, N-(trifluoroacetyl)-, 1-methylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.155178058 u |
| Formula | C13H22F3NO3 |
| InChI | InChI=1S/C13H22F3NO3/c1-5-6-9(4)20-11(18)10(7-8(2)3)17-12(19)13(14,15)16/h8-10H,5-7H2,1-4H3,(H,17,19) |
| InChIKey | KDZVUPCXIDZBSA-UHFFFAOYSA-N |
| Molecular Weight | 297.318 g/mol |
| SMILES | [C@](NC(C(F)(F)F)=O)(C(OC(CCC)C)=O)(CC(C)C)[H] |