| SpectraBase Compound ID | DL4yBagE26s |
|---|---|
| InChI | InChI=1S/C15H22BrNO/c1-3-5-6-9-12-17(4-2)15(18)13-10-7-8-11-14(13)16/h7-8,10-11H,3-6,9,12H2,1-2H3 |
| InChIKey | FRDUWWPEYWWXKB-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 | K3oq3mA9bbI |
|---|---|
| Name | Benzamide, 2-bromo-N-ethyl-N-hexyl- |
| 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/c1-3-5-6-9-12-17(4-2)15(18)13-10-7-8-11-14(13)16/h7-8,10-11H,3-6,9,12H2,1-2H3 |
| InChIKey | FRDUWWPEYWWXKB-UHFFFAOYSA-N |
| Molecular Weight | 312.251 g/mol |
| SMILES | C1=C(C(=CC=C1)C(N(CC)CCCCCC)=O)Br |