| SpectraBase Compound ID | 9fh5H2zs3zg |
|---|---|
| InChI | InChI=1S/C19H37NO4/c1-3-5-7-8-9-13-17-23-18(21)14-11-10-12-15-20-19(22)24-16-6-4-2/h3-17H2,1-2H3,(H,20,22) |
| InChIKey | OWLGMQLGJVKMGO-UHFFFAOYSA-N |
| Mol Weight | 343.5 g/mol |
| Molecular Formula | C19H37NO4 |
| Exact Mass | 343.272259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2XFUU2IhED2 |
|---|---|
| Name | 6-Aminocaproic acid, N-butoxycarbonyl-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.272258671 u |
| Formula | C19H37NO4 |
| InChI | InChI=1S/C19H37NO4/c1-3-5-7-8-9-13-17-23-18(21)14-11-10-12-15-20-19(22)24-16-6-4-2/h3-17H2,1-2H3,(H,20,22) |
| InChIKey | OWLGMQLGJVKMGO-UHFFFAOYSA-N |
| Molecular Weight | 343.508 g/mol |
| SMILES | CCCCOC(NCCCCCC(OCCCCCCCC)=O)=O |