| SpectraBase Compound ID | 4xRroaLl7c1 |
|---|---|
| InChI | InChI=1S/C19H16O4/c1-12(2)19(21)22-14-8-9-15-16(13-6-4-3-5-7-13)11-18(20)23-17(15)10-14/h3-12H,1-2H3 |
| InChIKey | YTJAUCXAFSBPNJ-UHFFFAOYSA-N |
| Mol Weight | 308.33 g/mol |
| Molecular Formula | C19H16O4 |
| Exact Mass | 308.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pcLcJlq5lE |
|---|---|
| Name | 7-Hydroxy-4-phenylcoumarin, 2-methylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.104858991 u |
| Formula | C19H16O4 |
| InChI | InChI=1S/C19H16O4/c1-12(2)19(21)22-14-8-9-15-16(13-6-4-3-5-7-13)11-18(20)23-17(15)10-14/h3-12H,1-2H3 |
| InChIKey | YTJAUCXAFSBPNJ-UHFFFAOYSA-N |
| SMILES | C1=2OC(C=C(C2C=CC(=C1)OC(C(C)C)=O)C1=CC=CC=C1)=O |