| SpectraBase Compound ID | J7uH2ED3h9t |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-5-7-8-9-10-11-14-17-22(19(4)6-2)21(23)20-16-13-12-15-18(20)3/h12-13,15-16,19H,5-11,14,17H2,1-4H3 |
| InChIKey | ATONCVBNGTYEGI-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 | D5R3Hti1v1N |
|---|---|
| Name | Benzamide, 2-methyl-N-(2-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/c1-5-7-8-9-10-11-14-17-22(19(4)6-2)21(23)20-16-13-12-15-18(20)3/h12-13,15-16,19H,5-11,14,17H2,1-4H3 |
| InChIKey | ATONCVBNGTYEGI-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | C(N(CCCCCCCCC)C(CC)C)(=O)C=1C(C)=CC=CC1 |