| SpectraBase Compound ID | 1AsrYZ8wy5r |
|---|---|
| InChI | InChI=1S/C26H31N3O6/c1-2-17-35-25(32)26(24(27)31,18-19-13-15-22(16-14-19)29(33)34)28(21-11-7-4-8-12-21)23(30)20-9-5-3-6-10-20/h3,5-6,9-10,13-16,21H,2,4,7-8,11-12,17-18H2,1H3,(H2,27,31)/t26-/m0/s1 |
| InChIKey | IAVLFHMEVOQVOI-SANMLTNESA-N |
| Mol Weight | 481.55 g/mol |
| Molecular Formula | C26H31N3O6 |
| Exact Mass | 481.221286 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ECVgFgT2QOi |
|---|---|
| Name | N-Benzoyl-N-cyclohexyl-4-nitro-a-(propoxycarbonyl) phenylalaninamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H31N3O6 |
| InChI | InChI=1S/C26H31N3O6/c1-2-17-35-25(32)26(24(27)31,18-19-13-15-22(16-14-19)29(33)34)28(21-11-7-4-8-12-21)23(30)20-9-5-3-6-10-20/h3,5-6,9-10,13-16,21H,2,4,7-8,11-12,17-18H2,1H3,(H2,27,31)/t26-/m0/s1 |
| InChIKey | IAVLFHMEVOQVOI-SANMLTNESA-N |
| Molecular Weight | 481.549 g/mol |
| SMILES | NC([C@@](N(C1CCCCC1)C(c1ccccc1)=O)(Cc1ccc(cc1)N(=O)=O)C(=O)OCCC)=O |
| SPLASH | splash10-0550-0931000000-74f5cee6d1e3440c3061 |
| Source of Spectrum | F-68-8050-7a |
| Wiley ID | 1717596 |