| SpectraBase Compound ID | BZD1SHcNVu6 |
|---|---|
| InChI | InChI=1S/C14H27NO4/c1-5-8-19-14(17)15-12(4)10-13(16)18-9-6-7-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | ZVTFBNKDIGBZSA-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 | 6DO2tqgGTZV |
|---|---|
| Name | 3-Aminobutyric acid, N-propoxycarbonyl-, isohexyl 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/c1-5-8-19-14(17)15-12(4)10-13(16)18-9-6-7-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | ZVTFBNKDIGBZSA-UHFFFAOYSA-N |
| SMILES | CCCOC(=O)NC(C)CC(OCCCC(C)C)=O |