![Isobutyl 2-[(4-methoxyanilino)carbonyl]-1-pyrrolidinecarboxylate](/api/spectrum/L26uJwwPBu1/structure.png?h=300&w=458 "Isobutyl 2-[(4-methoxyanilino)carbonyl]-1-pyrrolidinecarboxylate")
| SpectraBase Compound ID | EsYKkzaYub5 |
|---|---|
| InChI | InChI=1S/C17H24N2O4/c1-12(2)11-23-17(21)19-10-4-5-15(19)16(20)18-13-6-8-14(22-3)9-7-13/h6-9,12,15H,4-5,10-11H2,1-3H3,(H,18,20) |
| InChIKey | MBEIKBZQGWHCJR-UHFFFAOYSA-N |
| Mol Weight | 320.39 g/mol |
| Molecular Formula | C17H24N2O4 |
| Exact Mass | 320.173607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L26uJwwPBu1 |
|---|---|
| Name | Isobutyl 2-[(4-methoxyanilino)carbonyl]-1-pyrrolidinecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.173607257 u |
| Formula | C17H24N2O4 |
| InChI | InChI=1S/C17H24N2O4/c1-12(2)11-23-17(21)19-10-4-5-15(19)16(20)18-13-6-8-14(22-3)9-7-13/h6-9,12,15H,4-5,10-11H2,1-3H3,(H,18,20) |
| InChIKey | MBEIKBZQGWHCJR-UHFFFAOYSA-N |
| SMILES | N(C(C1N(C(OCC(C)C)=O)CCC1)=O)C=1C=CC(=CC1)OC |