| SpectraBase Compound ID | LI6rzXUeDqH |
|---|---|
| InChI | InChI=1S/C16H16BrNO/c1-3-18(15-9-4-6-12(2)10-15)16(19)13-7-5-8-14(17)11-13/h4-11H,3H2,1-2H3 |
| InChIKey | LRAJOVQWYFWYJH-UHFFFAOYSA-N |
| Mol Weight | 318.21 g/mol |
| Molecular Formula | C16H16BrNO |
| Exact Mass | 317.041527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IB8pWjVfPMO |
|---|---|
| Name | Benzamide, N-ethyl-N-(3-methylphenyl)-3-bromo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.041527138 u |
| Formula | C16H16BrNO |
| InChI | InChI=1S/C16H16BrNO/c1-3-18(15-9-4-6-12(2)10-15)16(19)13-7-5-8-14(17)11-13/h4-11H,3H2,1-2H3 |
| InChIKey | LRAJOVQWYFWYJH-UHFFFAOYSA-N |
| Molecular Weight | 318.214 g/mol |
| SMILES | C1(=CC=CC(=C1)C(N(CC)C=1C=CC=C(C)C1)=O)Br |