| SpectraBase Compound ID | EEk4hQQh9LT |
|---|---|
| InChI | InChI=1S/C25H30N2O6/c1-25(2,3)33-23(30)26-14-8-13-21(22(28)29)27-24(31)32-15-20-18-11-6-4-9-16(18)17-10-5-7-12-19(17)20/h4-7,9-12,20-21H,8,13-15H2,1-3H3,(H,26,30)(H,27,31)(H,28,29)/t21-/m0/s1 |
| InChIKey | JOOIZTMAHNLNHE-NRFANRHFSA-N |
| Mol Weight | 454.52 g/mol |
| Molecular Formula | C25H30N2O6 |
| Exact Mass | 454.210387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B2uaFjfuQhI |
|---|---|
| Name | Ndelta-tert-butyloxycarbonyl-nalpha-(9-fluorenylmethyloxycarbonyl)-L-ornithine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 454.210386688 u |
| Formula | C25H30N2O6 |
| InChI | InChI=1S/C25H30N2O6/c1-25(2,3)33-23(30)26-14-8-13-21(22(28)29)27-24(31)32-15-20-18-11-6-4-9-16(18)17-10-5-7-12-19(17)20/h4-7,9-12,20-21H,8,13-15H2,1-3H3,(H,26,30)(H,27,31)(H,28,29)/t21-/m0/s1 |
| InChIKey | JOOIZTMAHNLNHE-NRFANRHFSA-N |
| Molecular Weight | 454.523 g/mol |
| SMILES | N(C(OC(C)(C)C)=O)CCC[C@@](C(O)=O)(NC(OCC1C=2C=CC=CC2C=2C=CC=CC12)=O)[H] |