| SpectraBase Compound ID | 37oxjSFSp1V |
|---|---|
| InChI | InChI=1S/C11H18F3NO3/c1-5-7(4)18-9(16)8(6(2)3)15-10(17)11(12,13)14/h6-8H,5H2,1-4H3,(H,15,17) |
| InChIKey | BXZLFWSHYCWSSH-UHFFFAOYSA-N |
| Mol Weight | 269.26 g/mol |
| Molecular Formula | C11H18F3NO3 |
| Exact Mass | 269.123878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6zE1Zu76wBi |
|---|---|
| Name | L-Valine, N-(trifluoroacetyl)-, 1-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.123877930 u |
| Formula | C11H18F3NO3 |
| InChI | InChI=1S/C11H18F3NO3/c1-5-7(4)18-9(16)8(6(2)3)15-10(17)11(12,13)14/h6-8H,5H2,1-4H3,(H,15,17) |
| InChIKey | BXZLFWSHYCWSSH-UHFFFAOYSA-N |
| Molecular Weight | 269.264 g/mol |
| SMILES | [C@](NC(C(F)(F)F)=O)(C(OC(CC)C)=O)(C(C)C)[H] |