| SpectraBase Compound ID | 23KxnGj1W0P |
|---|---|
| InChI | InChI=1S/C16H27NO4/c1-4-7-8-9-10-13-20-15(18)14(11-5-2)17-16(19)21-12-6-3/h5-6,14H,2-4,7-13H2,1H3,(H,17,19) |
| InChIKey | ILDYYHLHMZVQDM-UHFFFAOYSA-N |
| Mol Weight | 297.4 g/mol |
| Molecular Formula | C16H27NO4 |
| Exact Mass | 297.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BQoNqJM6glt |
|---|---|
| Name | L-Allylglycine, N-allyloxycarbonyl-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.194008349 u |
| Formula | C16H27NO4 |
| InChI | InChI=1S/C16H27NO4/c1-4-7-8-9-10-13-20-15(18)14(11-5-2)17-16(19)21-12-6-3/h5-6,14H,2-4,7-13H2,1H3,(H,17,19) |
| InChIKey | ILDYYHLHMZVQDM-UHFFFAOYSA-N |
| Molecular Weight | 297.395 g/mol |
| SMILES | C=CCOC(NC(C(OCCCCCCC)=O)CC=C)=O |