| SpectraBase Compound ID | 4CFDxN9tTgG |
|---|---|
| InChI | InChI=1S/C19H14O6/c1-11(20)23-14-8-16(24-12(2)21)19-15(13-6-4-3-5-7-13)10-18(22)25-17(19)9-14/h3-10H,1-2H3 |
| InChIKey | KOLTWCNKPWEBQB-UHFFFAOYSA-N |
| Mol Weight | 338.32 g/mol |
| Molecular Formula | C19H14O6 |
| Exact Mass | 338.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 35XSCUAsBp7 |
|---|---|
| Name | 5,7-Dihydroxy-4-phenylcoumarin, diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.079038165 u |
| Formula | C19H14O6 |
| InChI | InChI=1S/C19H14O6/c1-11(20)23-14-8-16(24-12(2)21)19-15(13-6-4-3-5-7-13)10-18(22)25-17(19)9-14/h3-10H,1-2H3 |
| InChIKey | KOLTWCNKPWEBQB-UHFFFAOYSA-N |
| Molecular Weight | 338.315 g/mol |
| SMILES | C1(OC(=O)C)=CC(OC(=O)C)=CC2=C1C(C1=CC=CC=C1)=CC(O2)=O |