| SpectraBase Compound ID | JBmfofqOJbO |
|---|---|
| InChI | InChI=1S/C14H9BrO3/c15-13-7-2-1-6-12(13)14(17)18-11-5-3-4-10(8-11)9-16/h1-9H |
| InChIKey | AWFGTOPMPBQGDV-UHFFFAOYSA-N |
| Mol Weight | 305.13 g/mol |
| Molecular Formula | C14H9BrO3 |
| Exact Mass | 303.973507 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1hRRwhux3C6 |
|---|---|
| Name | 3-Formylphenyl 2-bromobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.973507147 u |
| Formula | C14H9BrO3 |
| InChI | InChI=1S/C14H9BrO3/c15-13-7-2-1-6-12(13)14(17)18-11-5-3-4-10(8-11)9-16/h1-9H |
| InChIKey | AWFGTOPMPBQGDV-UHFFFAOYSA-N |
| Molecular Weight | 305.127 g/mol |
| SMILES | C(C=1C(Br)=CC=CC1)(OC1=CC(C=O)=CC=C1)=O |