| SpectraBase Compound ID | Cxii1QxFGyL |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-4-6-8-9-10-11-12-17-22(16-7-5-2)21(23)20-15-13-14-19(3)18-20/h13-15,18H,4-12,16-17H2,1-3H3 |
| InChIKey | IGEUPQIPSSMTKO-UHFFFAOYSA-N |
| Mol Weight | 317.5 g/mol |
| Molecular Formula | C21H35NO |
| Exact Mass | 317.271865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0HXz1UFhET |
|---|---|
| Name | Benzamide, 3-methyl-N-butyl-N-nonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.271864750 u |
| Formula | C21H35NO |
| InChI | InChI=1S/C21H35NO/c1-4-6-8-9-10-11-12-17-22(16-7-5-2)21(23)20-15-13-14-19(3)18-20/h13-15,18H,4-12,16-17H2,1-3H3 |
| InChIKey | IGEUPQIPSSMTKO-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | C1=CC=C(C=C1C)C(N(CCCCCCCCC)CCCC)=O |