| SpectraBase Compound ID | 58kZ0hqsHPn |
|---|---|
| InChI | InChI=1S/C14H26N2O5/c1-8(2)7-10(13(18)20-5)15-12(17)11(9(3)4)16-14(19)21-6/h8-11H,7H2,1-6H3,(H,15,17)(H,16,19) |
| InChIKey | VZHJCXVNYBAYRF-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 | 6y617fClldt |
|---|---|
| Name | val-leu, 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(13(18)20-5)15-12(17)11(9(3)4)16-14(19)21-6/h8-11H,7H2,1-6H3,(H,15,17)(H,16,19) |
| InChIKey | VZHJCXVNYBAYRF-UHFFFAOYSA-N |
| Molecular Weight | 302.371 g/mol |
| SMILES | C(NC(C(=O)OC)CC(C)C)(C(NC(OC)=O)C(C)C)=O |