| SpectraBase Compound ID | BjgLImX1iRm |
|---|---|
| InChI | InChI=1S/C21H23NO3/c1-4-22(5-2)17-10-7-16-13-19(21(23)25-20(16)14-17)15-8-11-18(12-9-15)24-6-3/h7-14H,4-6H2,1-3H3 |
| InChIKey | ZXBYZMNWKCWCGW-UHFFFAOYSA-N |
| Mol Weight | 337.42 g/mol |
| Molecular Formula | C21H23NO3 |
| Exact Mass | 337.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8NBsyTcq8v6 |
|---|---|
| Name | 7-Diethylamino-3-(4'-ethoxyphenyl)coumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.167793602 u |
| Formula | C21H23NO3 |
| InChI | InChI=1S/C21H23NO3/c1-4-22(5-2)17-10-7-16-13-19(21(23)25-20(16)14-17)15-8-11-18(12-9-15)24-6-3/h7-14H,4-6H2,1-3H3 |
| InChIKey | ZXBYZMNWKCWCGW-UHFFFAOYSA-N |
| Molecular Weight | 337.419 g/mol |
| SMILES | C1(=CC=C(C=C1)OCC)C1=CC2=CC=C(C=C2OC1=O)N(CC)CC |