| SpectraBase Compound ID | 3HCDoGUtHNZ |
|---|---|
| InChI | InChI=1S/C14H11BrClNO/c1-9-2-7-12(16)8-13(9)17-14(18)10-3-5-11(15)6-4-10/h2-8H,1H3,(H,17,18) |
| InChIKey | PBVKVOYAZNRNAH-UHFFFAOYSA-N |
| Mol Weight | 324.61 g/mol |
| Molecular Formula | C14H11BrClNO |
| Exact Mass | 322.971255 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fhkxc5IDkc6 |
|---|---|
| Name | 4-Bromo-N-(5-chloro-2-methylphenyl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.971254677 u |
| Formula | C14H11BrClNO |
| InChI | InChI=1S/C14H11BrClNO/c1-9-2-7-12(16)8-13(9)17-14(18)10-3-5-11(15)6-4-10/h2-8H,1H3,(H,17,18) |
| InChIKey | PBVKVOYAZNRNAH-UHFFFAOYSA-N |
| Molecular Weight | 324.605 g/mol |
| SMILES | N(C(C1=CC=C(C=C1)Br)=O)C=1C=C(Cl)C=CC1C |