| SpectraBase Compound ID | GnGOCHlz0Sg |
|---|---|
| InChI | InChI=1S/C21H14O6/c22-19(23)14-6-10-17(11-7-14)27-21(25)16-8-12-18(13-9-16)26-20(24)15-4-2-1-3-5-15/h1-13H,(H,22,23) |
| InChIKey | BNJWMPQAKRREDL-UHFFFAOYSA-N |
| Mol Weight | 362.34 g/mol |
| Molecular Formula | C21H14O6 |
| Exact Mass | 362.079038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9SSDE6lldft |
|---|---|
| Name | 4-(4-Benzoyloxybenzoyloxy)benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 362.079038165 u |
| Formula | C21H14O6 |
| InChI | InChI=1S/C21H14O6/c22-19(23)14-6-10-17(11-7-14)27-21(25)16-8-12-18(13-9-16)26-20(24)15-4-2-1-3-5-15/h1-13H,(H,22,23) |
| InChIKey | BNJWMPQAKRREDL-UHFFFAOYSA-N |
| Molecular Weight | 362.337 g/mol |
| SMILES | C(OC1=CC=C(C=C1)C(O)=O)(=O)C1=CC=C(C=C1)OC(=O)C1=CC=CC=C1 |