| SpectraBase Compound ID | E7hcCeQklAZ |
|---|---|
| InChI | InChI=1S/C20H32BrNO/c1-4-6-7-8-9-10-13-16-22(17(3)5-2)20(23)18-14-11-12-15-19(18)21/h11-12,14-15,17H,4-10,13,16H2,1-3H3 |
| InChIKey | JFMNYLGUQWLIAL-UHFFFAOYSA-N |
| Mol Weight | 382.4 g/mol |
| Molecular Formula | C20H32BrNO |
| Exact Mass | 381.166728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3cQD6e6UVbt |
|---|---|
| Name | Benzamide, 2-bromo-N-(2-butyl)-N-nonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 381.166727653 u |
| Formula | C20H32BrNO |
| InChI | InChI=1S/C20H32BrNO/c1-4-6-7-8-9-10-13-16-22(17(3)5-2)20(23)18-14-11-12-15-19(18)21/h11-12,14-15,17H,4-10,13,16H2,1-3H3 |
| InChIKey | JFMNYLGUQWLIAL-UHFFFAOYSA-N |
| Molecular Weight | 382.386 g/mol |
| SMILES | C(=O)(N(CCCCCCCCC)C(CC)C)C=1C(Br)=CC=CC1 |