| SpectraBase Compound ID | 3Oqzgb0bDZa |
|---|---|
| InChI | InChI=1S/C19H23NO2/c1-13-7-5-6-8-17(13)19(21)20-15(3)12-16-9-10-18(22-4)14(2)11-16/h5-11,15H,12H2,1-4H3,(H,20,21) |
| InChIKey | ODWQZSZJIFBYFV-UHFFFAOYSA-N |
| Mol Weight | 297.4 g/mol |
| Molecular Formula | C19H23NO2 |
| Exact Mass | 297.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F9phol4eMPg |
|---|---|
| Name | 3-me-4-ma 2-Toluoyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.172878983 u |
| Formula | C19H23NO2 |
| InChI | InChI=1S/C19H23NO2/c1-13-7-5-6-8-17(13)19(21)20-15(3)12-16-9-10-18(22-4)14(2)11-16/h5-11,15H,12H2,1-4H3,(H,20,21) |
| InChIKey | ODWQZSZJIFBYFV-UHFFFAOYSA-N |
| SMILES | C=1(C(NC(CC2=CC(=C(C=C2)OC)C)C)=O)C(=CC=CC1)C |