| SpectraBase Compound ID | DB9npn9IC35 |
|---|---|
| InChI | InChI=1S/C20H23NO2/c1-2-18-19(23-15-17-11-7-4-8-12-17)13-20(22)21(18)14-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3 |
| InChIKey | UZXXTMRPHOWWAX-UHFFFAOYSA-N |
| Mol Weight | 309.41 g/mol |
| Molecular Formula | C20H23NO2 |
| Exact Mass | 309.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6HpipjbQ5MC |
|---|---|
| Name | 1-Benzyl-4-(benzyloxy)-5-ethyl-2-pyrrolidinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.172878983 u |
| Formula | C20H23NO2 |
| InChI | InChI=1S/C20H23NO2/c1-2-18-19(23-15-17-11-7-4-8-12-17)13-20(22)21(18)14-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3 |
| InChIKey | UZXXTMRPHOWWAX-UHFFFAOYSA-N |
| Molecular Weight | 309.409 g/mol |
| SMILES | C1(N(C(C(C1)OCC=1C=CC=CC1)CC)CC=1C=CC=CC1)=O |