| SpectraBase Compound ID | 2bHJX4ZIRYO |
|---|---|
| InChI | InChI=1S/C14H26N2O5/c1-8(2)7-10(15-14(19)21-6)12(17)16-11(9(3)4)13(18)20-5/h8-11H,7H2,1-6H3,(H,15,19)(H,16,17) |
| InChIKey | KBHAQYRSQALWQD-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 | PMnfYhm2al |
|---|---|
| Name | leu-val, N-Methoxycarbonyl-, methyl ester (isomer 1) |
| 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/c1-8(2)7-10(15-14(19)21-6)12(17)16-11(9(3)4)13(18)20-5/h8-11H,7H2,1-6H3,(H,15,19)(H,16,17) |
| InChIKey | KBHAQYRSQALWQD-UHFFFAOYSA-N |
| Molecular Weight | 302.371 g/mol |
| SMILES | C(C(CC(C)C)NC(OC)=O)(=O)NC(C(=O)OC)C(C)C |