| SpectraBase Compound ID | 1bzIsChKyTF |
|---|---|
| InChI | InChI=1S/C23H36N2O5/c1-5-7-14-20(22(27)29-15-17(3)4)24-21(26)19(11-6-2)25-23(28)30-16-18-12-9-8-10-13-18/h8-10,12-13,17,19-20H,5-7,11,14-16H2,1-4H3,(H,24,26)(H,25,28) |
| InChIKey | IDEORBRCFHBORQ-UHFFFAOYSA-N |
| Mol Weight | 420.6 g/mol |
| Molecular Formula | C23H36N2O5 |
| Exact Mass | 420.262422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fo0m9IvSRUc |
|---|---|
| Name | L-nva- L-nle, N-(Benzyloxycarbonyl)-, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 420.262422262 u |
| Formula | C23H36N2O5 |
| InChI | InChI=1S/C23H36N2O5/c1-5-7-14-20(22(27)29-15-17(3)4)24-21(26)19(11-6-2)25-23(28)30-16-18-12-9-8-10-13-18/h8-10,12-13,17,19-20H,5-7,11,14-16H2,1-4H3,(H,24,26)(H,25,28) |
| InChIKey | IDEORBRCFHBORQ-UHFFFAOYSA-N |
| Molecular Weight | 420.550 g/mol |
| SMILES | C1(=CC=CC=C1)COC(NC(C(NC(CCCC)C(=O)OCC(C)C)=O)CCC)=O |