| SpectraBase Compound ID | 4WCqLi9TzoR |
|---|---|
| InChI | InChI=1S/C23H33N3O5/c1-23(2,3)31-22(29)26-13-7-11-19(26)21(28)25-12-6-10-18(25)20(27)24-15-16-8-5-9-17(14-16)30-4/h5,8-9,14,18-19H,6-7,10-13,15H2,1-4H3,(H,24,27)/t18-,19-/m0/s1 |
| InChIKey | JIFYFCYMXAAHAW-OALUTQOASA-N |
| Mol Weight | 431.5 g/mol |
| Molecular Formula | C23H33N3O5 |
| Exact Mass | 431.242021 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8pYYkwD9MFf |
|---|---|
| Name | Tert-butyl (S)-2-((S)-2-((3-methoxybenzyl)carbamoyl)pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 431.242021170 u |
| Formula | C23H33N3O5 |
| InChI | InChI=1S/C23H33N3O5/c1-23(2,3)31-22(29)26-13-7-11-19(26)21(28)25-12-6-10-18(25)20(27)24-15-16-8-5-9-17(14-16)30-4/h5,8-9,14,18-19H,6-7,10-13,15H2,1-4H3,(H,24,27)/t18-,19-/m0/s1 |
| InChIKey | JIFYFCYMXAAHAW-OALUTQOASA-N |
| Molecular Weight | 431.533 g/mol |
| SMILES | [C@]1(N(CCC1)C(=O)OC(C)(C)C)(C(=O)N1[C@@](CCC1)(C(NCC1=CC(=CC=C1)OC)=O)[H])[H] |