| SpectraBase Compound ID | L0IPvUc10ap |
|---|---|
| InChI | InChI=1S/C18H16ClNO2/c19-16-8-6-13(7-9-16)10-15-11-17(21)20(18(15)22)12-14-4-2-1-3-5-14/h1-9,15H,10-12H2 |
| InChIKey | YXTNDPFDGNIKOZ-UHFFFAOYSA-N |
| Mol Weight | 313.78 g/mol |
| Molecular Formula | C18H16ClNO2 |
| Exact Mass | 313.086956 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8TWJgUjCMpP |
|---|---|
| Name | 1-Benzyl-4-(4-chlorobenzyl)pyrrolidin-2,5-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.086956457 u |
| Formula | C18H16ClNO2 |
| InChI | InChI=1S/C18H16ClNO2/c19-16-8-6-13(7-9-16)10-15-11-17(21)20(18(15)22)12-14-4-2-1-3-5-14/h1-9,15H,10-12H2 |
| InChIKey | YXTNDPFDGNIKOZ-UHFFFAOYSA-N |
| Molecular Weight | 313.784 g/mol |
| SMILES | C1(=CC=CC=C1)CN1C(=O)C(CC1=O)CC1=CC=C(C=C1)Cl |