| SpectraBase Compound ID | Gzn8oocCGxD |
|---|---|
| InChI | InChI=1S/C16H9F3O3/c17-16(18,19)10-3-1-2-9(6-10)13-8-15(21)22-14-7-11(20)4-5-12(13)14/h1-8,20H |
| InChIKey | VWKFVRVGEBQAQP-UHFFFAOYSA-N |
| Mol Weight | 306.24 g/mol |
| Molecular Formula | C16H9F3O3 |
| Exact Mass | 306.050379 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BKm4OMsI84 |
|---|---|
| Name | 7-Hydroxy-4-(3-trifluoromethylphenyl)coumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.050378636 u |
| Formula | C16H9F3O3 |
| InChI | InChI=1S/C16H9F3O3/c17-16(18,19)10-3-1-2-9(6-10)13-8-15(21)22-14-7-11(20)4-5-12(13)14/h1-8,20H |
| InChIKey | VWKFVRVGEBQAQP-UHFFFAOYSA-N |
| Molecular Weight | 306.240 g/mol |
| SMILES | C(F)(F)(F)C1=CC(=CC=C1)C1=CC(=O)OC=2C1=CC=C(C2)O |