| SpectraBase Compound ID | 7J4w7ryXXGo |
|---|---|
| InChI | InChI=1S/C14H26N2O5/c1-5-8-9-11(13(18)20-6-2)16-12(17)10(4)15-14(19)21-7-3/h10-11H,5-9H2,1-4H3,(H,15,19)(H,16,17) |
| InChIKey | GCKHJESYAQVTHL-UHFFFAOYSA-N |
| Mol Weight | 302.37 g/mol |
| Molecular Formula | C14H26N2O5 |
| Exact Mass | 302.184172 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2wG1XP2zbSZ |
|---|---|
| Name | L-ala-L-nle, N-(Ethoxycarbonyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.184171940 u |
| Formula | C14H26N2O5 |
| InChI | InChI=1S/C14H26N2O5/c1-5-8-9-11(13(18)20-6-2)16-12(17)10(4)15-14(19)21-7-3/h10-11H,5-9H2,1-4H3,(H,15,19)(H,16,17) |
| InChIKey | GCKHJESYAQVTHL-UHFFFAOYSA-N |
| Molecular Weight | 302.371 g/mol |
| SMILES | C(C(NC(=O)C(C)NC(OCC)=O)C(=O)OCC)CCC |