| SpectraBase Compound ID | 1LIrFXHMAeZ |
|---|---|
| InChI | InChI=1S/C18H26N2O3/c1-13(14-9-6-5-7-10-14)19-16(21)15-11-8-12-20(15)17(22)23-18(2,3)4/h5-7,9-10,13,15H,8,11-12H2,1-4H3,(H,19,21)/t13-,15-/m0/s1 |
| InChIKey | NRCIIYINZAFCAN-ZFWWWQNUSA-N |
| Mol Weight | 318.42 g/mol |
| Molecular Formula | C18H26N2O3 |
| Exact Mass | 318.194343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BOELrn7ac5X |
|---|---|
| Name | Tert-butyl (S)-2-(((S)-1-phenylethyl)carbamoyl)pyrrolidine-1-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.194342702 u |
| Formula | C18H26N2O3 |
| InChI | InChI=1S/C18H26N2O3/c1-13(14-9-6-5-7-10-14)19-16(21)15-11-8-12-20(15)17(22)23-18(2,3)4/h5-7,9-10,13,15H,8,11-12H2,1-4H3,(H,19,21)/t13-,15-/m0/s1 |
| InChIKey | NRCIIYINZAFCAN-ZFWWWQNUSA-N |
| Molecular Weight | 318.417 g/mol |
| SMILES | [C@]1(N(CCC1)C(=O)OC(C)(C)C)(C(N[C@@](C)(C1=CC=CC=C1)[H])=O)[H] |