| SpectraBase Compound ID | JHlJBtNJInm |
|---|---|
| InChI | InChI=1S/C15H25NO4/c1-3-5-6-7-8-9-13-19-14(17)10-11-16-15(18)20-12-4-2/h2H,3,5-13H2,1H3,(H,16,18) |
| InChIKey | HQGLJYRWHVAUHB-UHFFFAOYSA-N |
| Mol Weight | 283.37 g/mol |
| Molecular Formula | C15H25NO4 |
| Exact Mass | 283.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7tVHPDvg9DS |
|---|---|
| Name | .beta.-Alanine, N-propargyloxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.178358285 u |
| Formula | C15H25NO4 |
| InChI | InChI=1S/C15H25NO4/c1-3-5-6-7-8-9-13-19-14(17)10-11-16-15(18)20-12-4-2/h2H,3,5-13H2,1H3,(H,16,18) |
| InChIKey | HQGLJYRWHVAUHB-UHFFFAOYSA-N |
| SMILES | C#CCOC(NCCC(OCCCCCCCC)=O)=O |