| SpectraBase Compound ID | 7CeZaedo1ud |
|---|---|
| InChI | InChI=1S/C15H21NO4/c1-3-4-10-19-14(17)12(2)16-15(18)20-11-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1 |
| InChIKey | NGNFMKOLTTXJDB-LBPRGKRZSA-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 | DfEs7kwbD1M |
|---|---|
| Name | L-Alanine, N-benzyloxycarbonyl-, butyl 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/c1-3-4-10-19-14(17)12(2)16-15(18)20-11-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1 |
| InChIKey | NGNFMKOLTTXJDB-LBPRGKRZSA-N |
| Molecular Weight | 279.336 g/mol |
| SMILES | CCCCOC([C@@](NC(OCC1=CC=CC=C1)=O)(C)[H])=O |