| SpectraBase Compound ID | D2lkg02UU2K |
|---|---|
| InChI | InChI=1S/C14H27NO4/c1-4-10-18-13(16)8-6-5-7-9-15-14(17)19-11-12(2)3/h12H,4-11H2,1-3H3,(H,15,17) |
| InChIKey | XVVJCYICNGNZJT-UHFFFAOYSA-N |
| Mol Weight | 273.37 g/mol |
| Molecular Formula | C14H27NO4 |
| Exact Mass | 273.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4nOlWw1IakK |
|---|---|
| Name | 6-Aminocaproic acid, N-isobutoxycarbonyl-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.194008349 u |
| Formula | C14H27NO4 |
| InChI | InChI=1S/C14H27NO4/c1-4-10-18-13(16)8-6-5-7-9-15-14(17)19-11-12(2)3/h12H,4-11H2,1-3H3,(H,15,17) |
| InChIKey | XVVJCYICNGNZJT-UHFFFAOYSA-N |
| SMILES | C(COC(NCCCCCC(OCCC)=O)=O)(C)C |