| SpectraBase Compound ID | 2mKuevrYG8w |
|---|---|
| InChI | InChI=1S/C16H23NO4/c1-5-10-21-16(19)14(11(2)3)17-15(18)12-8-6-7-9-13(12)20-4/h6-9,11,14H,5,10H2,1-4H3,(H,17,18) |
| InChIKey | DDHZEEMBYBDWJU-UHFFFAOYSA-N |
| Mol Weight | 293.36 g/mol |
| Molecular Formula | C16H23NO4 |
| Exact Mass | 293.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2E8gl5gMad6 |
|---|---|
| Name | L-Valine, N-(2-methoxybenzoyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.162708221 u |
| Formula | C16H23NO4 |
| InChI | InChI=1S/C16H23NO4/c1-5-10-21-16(19)14(11(2)3)17-15(18)12-8-6-7-9-13(12)20-4/h6-9,11,14H,5,10H2,1-4H3,(H,17,18) |
| InChIKey | DDHZEEMBYBDWJU-UHFFFAOYSA-N |
| SMILES | C1=CC=CC(=C1OC)C(NC(C(C)C)C(OCCC)=O)=O |