| SpectraBase Compound ID | 9mhSXvPJHIg |
|---|---|
| InChI | InChI=1S/C16H12O3/c1-10-15(11-5-3-2-4-6-11)13-8-7-12(17)9-14(13)19-16(10)18/h2-9,17H,1H3 |
| InChIKey | JILNSPBYFPSJRO-UHFFFAOYSA-N |
| Mol Weight | 252.27 g/mol |
| Molecular Formula | C16H12O3 |
| Exact Mass | 252.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EdLQ1wHuCtk |
|---|---|
| Name | 7-Hydroxy-3-methyl-4-phenylcoumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.078644243 u |
| Formula | C16H12O3 |
| InChI | InChI=1S/C16H12O3/c1-10-15(11-5-3-2-4-6-11)13-8-7-12(17)9-14(13)19-16(10)18/h2-9,17H,1H3 |
| InChIKey | JILNSPBYFPSJRO-UHFFFAOYSA-N |
| Molecular Weight | 252.269 g/mol |
| SMILES | C1(O)=CC=C2C(=C(C(OC2=C1)=O)C)C1=CC=CC=C1 |