| SpectraBase Compound ID | 7PGwHXjirOD |
|---|---|
| InChI | InChI=1S/C20H25NO4/c1-4-19(22)21-11-10-16-12-17(23-2)20(18(13-16)24-3)25-14-15-8-6-5-7-9-15/h5-9,12-13H,4,10-11,14H2,1-3H3,(H,21,22) |
| InChIKey | OQSUNYQNFVILOM-UHFFFAOYSA-N |
| Mol Weight | 343.42 g/mol |
| Molecular Formula | C20H25NO4 |
| Exact Mass | 343.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EVdcHznVhuw |
|---|---|
| Name | bz Prop |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.178358285 u |
| Formula | C20H25NO4 |
| InChI | InChI=1S/C20H25NO4/c1-4-19(22)21-11-10-16-12-17(23-2)20(18(13-16)24-3)25-14-15-8-6-5-7-9-15/h5-9,12-13H,4,10-11,14H2,1-3H3,(H,21,22) |
| InChIKey | OQSUNYQNFVILOM-UHFFFAOYSA-N |
| Molecular Weight | 343.423 g/mol |
| SMILES | C1(=C(C=C(C=C1OC)CCNC(CC)=O)OC)OCC1=CC=CC=C1 |