| SpectraBase Compound ID | GGx40IkHuIj |
|---|---|
| InChI | InChI=1S/C16H29NO4/c1-5-7-8-9-11-20-15(18)14(10-6-2)17-16(19)21-12-13(3)4/h6,13-14H,2,5,7-12H2,1,3-4H3,(H,17,19) |
| InChIKey | HGCUPNHJXPETDH-UHFFFAOYSA-N |
| Mol Weight | 299.41 g/mol |
| Molecular Formula | C16H29NO4 |
| Exact Mass | 299.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DCMqvxTiqd |
|---|---|
| Name | L-Allylglycine, N-isobutoxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.209658414 u |
| Formula | C16H29NO4 |
| InChI | InChI=1S/C16H29NO4/c1-5-7-8-9-11-20-15(18)14(10-6-2)17-16(19)21-12-13(3)4/h6,13-14H,2,5,7-12H2,1,3-4H3,(H,17,19) |
| InChIKey | HGCUPNHJXPETDH-UHFFFAOYSA-N |
| SMILES | C(C(NC(OCC(C)C)=O)C(=O)OCCCCCC)C=C |