| SpectraBase Compound ID | CaBUjB7PCAF |
|---|---|
| InChI | InChI=1S/C14H27NO5/c1-3-4-10-19-13(16)8-6-5-7-9-15-14(17)20-12-11-18-2/h3-12H2,1-2H3,(H,15,17) |
| InChIKey | JMQYRHARGIEEBA-UHFFFAOYSA-N |
| Mol Weight | 289.37 g/mol |
| Molecular Formula | C14H27NO5 |
| Exact Mass | 289.188923 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | PA50Rn9wPS |
|---|---|
| Name | 6-Aminocaproic acid, N-(2-methoxyethoxycarbonyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.188922968 u |
| Formula | C14H27NO5 |
| InChI | InChI=1S/C14H27NO5/c1-3-4-10-19-13(16)8-6-5-7-9-15-14(17)20-12-11-18-2/h3-12H2,1-2H3,(H,15,17) |
| InChIKey | JMQYRHARGIEEBA-UHFFFAOYSA-N |
| SMILES | COCCOC(NCCCCCC(OCCCC)=O)=O |