| SpectraBase Compound ID | 4fGyiCdSgI1 |
|---|---|
| InChI | InChI=1S/C14H27NO4/c1-5-8-10-18-13(16)12(11(4)7-3)15-14(17)19-9-6-2/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | QGDFPSHLKGPZOA-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 | ABPF3Txhnv4 |
|---|---|
| Name | L-Isoleucine, N-propoxycarbonyl-, butyl 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/c1-5-8-10-18-13(16)12(11(4)7-3)15-14(17)19-9-6-2/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | QGDFPSHLKGPZOA-UHFFFAOYSA-N |
| SMILES | CCCOC(NC(C(CC)C)C(OCCCC)=O)=O |