| SpectraBase Compound ID | IVRluuEs5c9 |
|---|---|
| InChI | InChI=1S/C20H32BrNO/c1-3-5-6-7-8-9-10-11-12-17-22(4-2)20(23)18-13-15-19(21)16-14-18/h13-16H,3-12,17H2,1-2H3 |
| InChIKey | DXXPJWOUMFFSSY-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 | 7b5jBuhjQ75 |
|---|---|
| Name | Benzamide, 4-bromo-N-ethyl-N-undecyl- |
| 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/c1-3-5-6-7-8-9-10-11-12-17-22(4-2)20(23)18-13-15-19(21)16-14-18/h13-16H,3-12,17H2,1-2H3 |
| InChIKey | DXXPJWOUMFFSSY-UHFFFAOYSA-N |
| Molecular Weight | 382.386 g/mol |
| SMILES | C1(=CC=C(C=C1)C(N(CC)CCCCCCCCCCC)=O)Br |