| SpectraBase Compound ID | HdmDxzdCZiv |
|---|---|
| InChI | InChI=1S/C16H21NO4/c1-3-8-14(15(18)20-11-4-2)17-16(19)21-12-13-9-6-5-7-10-13/h3,5-7,9-10,14H,1,4,8,11-12H2,2H3,(H,17,19) |
| InChIKey | IPLPGGRVWZIEKN-UHFFFAOYSA-N |
| Mol Weight | 291.35 g/mol |
| Molecular Formula | C16H21NO4 |
| Exact Mass | 291.147058 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3NaIj9cuDJ |
|---|---|
| Name | D-Allylglycine, N-benzyloxycarbonyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.147058156 u |
| Formula | C16H21NO4 |
| InChI | InChI=1S/C16H21NO4/c1-3-8-14(15(18)20-11-4-2)17-16(19)21-12-13-9-6-5-7-10-13/h3,5-7,9-10,14H,1,4,8,11-12H2,2H3,(H,17,19) |
| InChIKey | IPLPGGRVWZIEKN-UHFFFAOYSA-N |
| SMILES | C(NC(OCC1=CC=CC=C1)=O)(C(=O)OCCC)CC=C |