| SpectraBase Compound ID | 1Gaqc7HIBst |
|---|---|
| InChI | InChI=1S/C13H9BrClNO/c14-10-4-1-3-9(7-10)13(17)16-12-6-2-5-11(15)8-12/h1-8H,(H,16,17) |
| InChIKey | NJSBTVPSISSHNU-UHFFFAOYSA-N |
| Mol Weight | 310.58 g/mol |
| Molecular Formula | C13H9BrClNO |
| Exact Mass | 308.955605 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6anko0KlSpO |
|---|---|
| Name | Benzamide, N-(3-chlorophenyl)-3-bromo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.955604613 u |
| Formula | C13H9BrClNO |
| InChI | InChI=1S/C13H9BrClNO/c14-10-4-1-3-9(7-10)13(17)16-12-6-2-5-11(15)8-12/h1-8H,(H,16,17) |
| InChIKey | NJSBTVPSISSHNU-UHFFFAOYSA-N |
| Molecular Weight | 310.578 g/mol |
| SMILES | C1=CC=C(C=C1Br)C(NC1=CC(=CC=C1)Cl)=O |