| SpectraBase Compound ID | 9SSvqtKlz0k |
|---|---|
| InChI | InChI=1S/C21H26ClNO/c1-2-3-4-5-11-16-23(17-18-12-7-6-8-13-18)21(24)19-14-9-10-15-20(19)22/h6-10,12-15H,2-5,11,16-17H2,1H3 |
| InChIKey | WQWUOJWCITWECJ-UHFFFAOYSA-N |
| Mol Weight | 343.9 g/mol |
| Molecular Formula | C21H26ClNO |
| Exact Mass | 343.170292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AvwcV81l9ue |
|---|---|
| Name | Benzamide, 2-chloro-N-benzyl-N-heptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.170292160 u |
| Formula | C21H26ClNO |
| InChI | InChI=1S/C21H26ClNO/c1-2-3-4-5-11-16-23(17-18-12-7-6-8-13-18)21(24)19-14-9-10-15-20(19)22/h6-10,12-15H,2-5,11,16-17H2,1H3 |
| InChIKey | WQWUOJWCITWECJ-UHFFFAOYSA-N |
| Molecular Weight | 343.898 g/mol |
| SMILES | C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C=1C(Cl)=CC=CC1 |