| SpectraBase Compound ID | 5sqGNOJVewG |
|---|---|
| InChI | InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-15(19)21-14-7-10(17)6-13(18)16(12)14/h2-7,12,17-18H,8H2,1H3 |
| InChIKey | OKBWVJGQTFYYQA-UHFFFAOYSA-N |
| Mol Weight | 286.28 g/mol |
| Molecular Formula | C16H14O5 |
| Exact Mass | 286.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ulzkkYTzbq |
|---|---|
| Name | 3,4-Dihydro-5,7-dihydroxy-4-(4-methoxyphenyl)coumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.084123546 u |
| Formula | C16H14O5 |
| InChI | InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-15(19)21-14-7-10(17)6-13(18)16(12)14/h2-7,12,17-18H,8H2,1H3 |
| InChIKey | OKBWVJGQTFYYQA-UHFFFAOYSA-N |
| SMILES | C1(OC2=C(C(C1)C1=CC=C(C=C1)OC)C(=CC(=C2)O)O)=O |