| SpectraBase Compound ID | 1AoE37KWQLL |
|---|---|
| InChI | InChI=1S/C23H29N3O2/c1-23(2,3)18-13-11-17(12-14-18)16-24-21(27)20-10-7-15-26(20)22(28)25-19-8-5-4-6-9-19/h4-6,8-9,11-14,20H,7,10,15-16H2,1-3H3,(H,24,27)(H,25,28) |
| InChIKey | GSFIUJPPVHZLHP-UHFFFAOYSA-N |
| Mol Weight | 379.5 g/mol |
| Molecular Formula | C23H29N3O2 |
| Exact Mass | 379.225977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Inol1fu8AQ |
|---|---|
| Name | Pyrrolidine-1,2-dicarboxylic acid 2-(4-tert-butylbenzylamide) 1-phenylamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 379.225977184 u |
| Formula | C23H29N3O2 |
| InChI | InChI=1S/C23H29N3O2/c1-23(2,3)18-13-11-17(12-14-18)16-24-21(27)20-10-7-15-26(20)22(28)25-19-8-5-4-6-9-19/h4-6,8-9,11-14,20H,7,10,15-16H2,1-3H3,(H,24,27)(H,25,28) |
| InChIKey | GSFIUJPPVHZLHP-UHFFFAOYSA-N |
| Molecular Weight | 379.504 g/mol |
| SMILES | C1C(N(C(NC2=CC=CC=C2)=O)CC1)C(NCC1=CC=C(C(C)(C)C)C=C1)=O |