| SpectraBase Compound ID | 9EOjl1fTa7F |
|---|---|
| InChI | InChI=1S/C14H27NO4/c1-6-8-9-10-19-12(16)11(14(3,4)5)15-13(17)18-7-2/h11H,6-10H2,1-5H3,(H,15,17) |
| InChIKey | PCPNAKCXYFFPLL-UHFFFAOYSA-N |
| Mol Weight | 273.37 g/mol |
| Molecular Formula | C14H27NO4 |
| Exact Mass | 273.194008 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FHwWcgRjHyn |
|---|---|
| Name | Tert-leucine, N-ethoxycarbonyl-, pentyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.194008349 u |
| Formula | C14H27NO4 |
| InChI | InChI=1S/C14H27NO4/c1-6-8-9-10-19-12(16)11(14(3,4)5)15-13(17)18-7-2/h11H,6-10H2,1-5H3,(H,15,17) |
| InChIKey | PCPNAKCXYFFPLL-UHFFFAOYSA-N |
| SMILES | CCCCCOC(C(NC(OCC)=O)C(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.835294 |