| SpectraBase Compound ID | AuKWO2eY9Cg |
|---|---|
| InChI | InChI=1S/C20H29N3O6/c1-4-28-18(25)12-21-17(24)11-22-19(26)16(10-14(2)3)23-20(27)29-13-15-8-6-5-7-9-15/h5-9,14,16H,4,10-13H2,1-3H3,(H,21,24)(H,22,26)(H,23,27)/t16-/m0/s1 |
| InChIKey | WFBDODLQRYRESP-INIZCTEOSA-N |
| Mol Weight | 407.47 g/mol |
| Molecular Formula | C20H29N3O6 |
| Exact Mass | 407.205636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KLaDa5pBMcc |
|---|---|
| Name | Ethyl-N-(benzyloxycarbonyl)-leucylglycylglycine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 407.205635660 u |
| Formula | C20H29N3O6 |
| InChI | InChI=1S/C20H29N3O6/c1-4-28-18(25)12-21-17(24)11-22-19(26)16(10-14(2)3)23-20(27)29-13-15-8-6-5-7-9-15/h5-9,14,16H,4,10-13H2,1-3H3,(H,21,24)(H,22,26)(H,23,27)/t16-/m0/s1 |
| InChIKey | WFBDODLQRYRESP-INIZCTEOSA-N |
| Molecular Weight | 407.467 g/mol |
| SMILES | C(N[C@](C(NCC(NCC(=O)OCC)=O)=O)(CC(C)C)[H])(=O)OCC1=CC=CC=C1 |