| SpectraBase Compound ID | CGvjQ0f77Vz |
|---|---|
| InChI | InChI=1S/C15H25NO4/c1-5-8-13(16-15(18)20-10-6-2)14(17)19-11-7-9-12(3)4/h5-6,12-13H,1-2,7-11H2,3-4H3,(H,16,18) |
| InChIKey | BIBXUCSUFVGEIA-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 | 2AQnFaHNHaQ |
|---|---|
| Name | L-Allylglycine, N-allyloxycarbonyl-, isohexyl 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/c1-5-8-13(16-15(18)20-10-6-2)14(17)19-11-7-9-12(3)4/h5-6,12-13H,1-2,7-11H2,3-4H3,(H,16,18) |
| InChIKey | BIBXUCSUFVGEIA-UHFFFAOYSA-N |
| SMILES | C=CCOC(NC(CC=C)C(OCCCC(C)C)=O)=O |