| SpectraBase Compound ID | LnBP2ae0Nes |
|---|---|
| InChI | InChI=1S/C15H27NO4/c1-6-8-10-19-13(17)12(9-7-2)16-14(18)20-11-15(3,4)5/h7,12H,2,6,8-11H2,1,3-5H3,(H,16,18) |
| InChIKey | JXEXLKDZWJVMNN-UHFFFAOYSA-N |
| Mol Weight | 285.38 g/mol |
| Molecular Formula | C15H27NO4 |
| Exact Mass | 285.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KlB3XvgK4UA |
|---|---|
| Name | L-Allylglycine, N-neopentyloxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.194008349 u |
| Formula | C15H27NO4 |
| InChI | InChI=1S/C15H27NO4/c1-6-8-10-19-13(17)12(9-7-2)16-14(18)20-11-15(3,4)5/h7,12H,2,6,8-11H2,1,3-5H3,(H,16,18) |
| InChIKey | JXEXLKDZWJVMNN-UHFFFAOYSA-N |
| SMILES | CCCCOC(C(NC(OCC(C)(C)C)=O)CC=C)=O |