| SpectraBase Compound ID | 2CgikxmwWlK |
|---|---|
| InChI | InChI=1S/C19H35NO4/c1-6-8-9-10-11-12-14-23-17(21)16(13-7-2)20-18(22)24-15-19(3,4)5/h7,16H,2,6,8-15H2,1,3-5H3,(H,20,22) |
| InChIKey | XGCCSMKNSZMCMC-UHFFFAOYSA-N |
| Mol Weight | 341.5 g/mol |
| Molecular Formula | C19H35NO4 |
| Exact Mass | 341.256609 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L78O4dwsTL8 |
|---|---|
| Name | L-Allylglycine, N-neopentyloxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.256608607 u |
| Formula | C19H35NO4 |
| InChI | InChI=1S/C19H35NO4/c1-6-8-9-10-11-12-14-23-17(21)16(13-7-2)20-18(22)24-15-19(3,4)5/h7,16H,2,6,8-15H2,1,3-5H3,(H,20,22) |
| InChIKey | XGCCSMKNSZMCMC-UHFFFAOYSA-N |
| Molecular Weight | 341.492 g/mol |
| SMILES | CCCCCCCCOC(C(NC(OCC(C)(C)C)=O)CC=C)=O |