| SpectraBase Compound ID | 4m7qn9KDWau |
|---|---|
| InChI | InChI=1S/C20H31NO/c1-3-4-6-11-17(2)21(16-18-12-7-5-8-13-18)20(22)19-14-9-10-15-19/h5,7-8,12-13,17,19H,3-4,6,9-11,14-16H2,1-2H3 |
| InChIKey | DSSXOKPLGYWQDM-UHFFFAOYSA-N |
| Mol Weight | 301.47 g/mol |
| Molecular Formula | C20H31NO |
| Exact Mass | 301.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HKjAE9qw2MZ |
|---|---|
| Name | Cyclopentanecarboxamide, N-benzyl-N-(hept-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.240564621 u |
| Formula | C20H31NO |
| InChI | InChI=1S/C20H31NO/c1-3-4-6-11-17(2)21(16-18-12-7-5-8-13-18)20(22)19-14-9-10-15-19/h5,7-8,12-13,17,19H,3-4,6,9-11,14-16H2,1-2H3 |
| InChIKey | DSSXOKPLGYWQDM-UHFFFAOYSA-N |
| SMILES | C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)C1CCCC1 |