| SpectraBase Compound ID | ByMutPhpeJP |
|---|---|
| InChI | InChI=1S/C13H21NO5/c1-5-18-11(16)9-8-14(7-6-10(9)15)12(17)19-13(2,3)4/h9H,5-8H2,1-4H3 |
| InChIKey | ABBVAMUCDQETDO-UHFFFAOYSA-N |
| Mol Weight | 271.31 g/mol |
| Molecular Formula | C13H21NO5 |
| Exact Mass | 271.141973 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CDdVHJr4eI |
|---|---|
| Name | Ethyl 1-tert-butoxycarbonyl-4-oxo-3-piperidinecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.141972775 u |
| Formula | C13H21NO5 |
| InChI | InChI=1S/C13H21NO5/c1-5-18-11(16)9-8-14(7-6-10(9)15)12(17)19-13(2,3)4/h9H,5-8H2,1-4H3 |
| InChIKey | ABBVAMUCDQETDO-UHFFFAOYSA-N |
| SMILES | C1C(C(CN(C1)C(OC(C)(C)C)=O)C(OCC)=O)=O |