| SpectraBase Compound ID | FMy8LHdY5Zl |
|---|---|
| InChI | InChI=1S/C21H35NO2/c1-3-5-7-9-13-17-22(19-20-15-11-10-12-16-20)21(23)24-18-14-8-6-4-2/h10-12,15-16H,3-9,13-14,17-19H2,1-2H3 |
| InChIKey | XOIPTHBLHIZFRI-UHFFFAOYSA-N |
| Mol Weight | 333.5 g/mol |
| Molecular Formula | C21H35NO2 |
| Exact Mass | 333.266779 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K06Ydpzlq3T |
|---|---|
| Name | Carbonic acid, monoamide, N-benzyl-N-heptyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.266779369 u |
| Formula | C21H35NO2 |
| InChI | InChI=1S/C21H35NO2/c1-3-5-7-9-13-17-22(19-20-15-11-10-12-16-20)21(23)24-18-14-8-6-4-2/h10-12,15-16H,3-9,13-14,17-19H2,1-2H3 |
| InChIKey | XOIPTHBLHIZFRI-UHFFFAOYSA-N |
| Molecular Weight | 333.516 g/mol |
| SMILES | CCCCCCOC(=O)N(CCCCCCC)CC1=CC=CC=C1 |