| SpectraBase Compound ID | KdVF6qithgQ |
|---|---|
| InChI | InChI=1S/C15H21NO4/c1-10(2)9-20-15(18)11(3)16-14(17)12-6-5-7-13(8-12)19-4/h5-8,10-11H,9H2,1-4H3,(H,16,17) |
| InChIKey | XBITYYZYDAXOBD-UHFFFAOYSA-N |
| Mol Weight | 279.34 g/mol |
| Molecular Formula | C15H21NO4 |
| Exact Mass | 279.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 15Bn6y3A8kK |
|---|---|
| Name | L-Alanine, N-(m-anisoyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.147058156 u |
| Formula | C15H21NO4 |
| InChI | InChI=1S/C15H21NO4/c1-10(2)9-20-15(18)11(3)16-14(17)12-6-5-7-13(8-12)19-4/h5-8,10-11H,9H2,1-4H3,(H,16,17) |
| InChIKey | XBITYYZYDAXOBD-UHFFFAOYSA-N |
| Molecular Weight | 279.336 g/mol |
| SMILES | C1=CC(=CC(=C1)OC)C(NC(C(OCC(C)C)=O)C)=O |