| SpectraBase Compound ID | 2i3y0UF7Sbg |
|---|---|
| InChI | InChI=1S/C27H34N2O6/c1-16(2)14-22(23(24(30)31)29-26(33)35-27(3,4)5)28-25(32)34-15-21-19-12-8-6-10-17(19)18-11-7-9-13-20(18)21/h6-13,16,21-23H,14-15H2,1-5H3,(H,28,32)(H,29,33)(H,30,31) |
| InChIKey | SYVVVTVYBGIXKT-UHFFFAOYSA-N |
| Mol Weight | 482.6 g/mol |
| Molecular Formula | C27H34N2O6 |
| Exact Mass | 482.241687 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BDhDBa3UZkx |
|---|---|
| Name | 3-(N-Fluoren-9-ylmethoxycarbonylamino)-3-isobutyl-2-(tert-butyloxycarbonylamino)propanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 482.241686817 u |
| Formula | C27H34N2O6 |
| InChI | InChI=1S/C27H34N2O6/c1-16(2)14-22(23(24(30)31)29-26(33)35-27(3,4)5)28-25(32)34-15-21-19-12-8-6-10-17(19)18-11-7-9-13-20(18)21/h6-13,16,21-23H,14-15H2,1-5H3,(H,28,32)(H,29,33)(H,30,31) |
| InChIKey | SYVVVTVYBGIXKT-UHFFFAOYSA-N |
| Molecular Weight | 482.577 g/mol |
| SMILES | C(C(NC(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)CC(C)C)(NC(OC(C)(C)C)=O)C(=O)O |