| SpectraBase Compound ID | OUqw0cI6dz |
|---|---|
| InChI | InChI=1S/C15H22BrNO/c1-3-4-5-6-7-11-17(2)15(18)13-9-8-10-14(16)12-13/h8-10,12H,3-7,11H2,1-2H3 |
| InChIKey | HLBSYJIXCHTVJT-UHFFFAOYSA-N |
| Mol Weight | 312.25 g/mol |
| Molecular Formula | C15H22BrNO |
| Exact Mass | 311.088477 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DO42ziiS3Wh |
|---|---|
| Name | Benzamide, 3-bromo-N-methyl-N-heptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.088477331 u |
| Formula | C15H22BrNO |
| InChI | InChI=1S/C15H22BrNO/c1-3-4-5-6-7-11-17(2)15(18)13-9-8-10-14(16)12-13/h8-10,12H,3-7,11H2,1-2H3 |
| InChIKey | HLBSYJIXCHTVJT-UHFFFAOYSA-N |
| Molecular Weight | 312.251 g/mol |
| SMILES | C(=O)(N(CCCCCCC)C)C=1C=CC=C(Br)C1 |