| SpectraBase Compound ID | IyFBw3VXgLH |
|---|---|
| InChI | InChI=1S/C25H42ClNO/c1-3-5-7-9-11-13-15-21-27(22-16-14-12-10-8-6-4-2)25(28)23-17-19-24(26)20-18-23/h17-20H,3-16,21-22H2,1-2H3 |
| InChIKey | KFTWLRGQCLZIHZ-UHFFFAOYSA-N |
| Mol Weight | 408.1 g/mol |
| Molecular Formula | C25H42ClNO |
| Exact Mass | 407.295493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KFOHdNhH48i |
|---|---|
| Name | Benzamide, N,N-dinonyl-4-chloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 407.295492675 u |
| Formula | C25H42ClNO |
| InChI | InChI=1S/C25H42ClNO/c1-3-5-7-9-11-13-15-21-27(22-16-14-12-10-8-6-4-2)25(28)23-17-19-24(26)20-18-23/h17-20H,3-16,21-22H2,1-2H3 |
| InChIKey | KFTWLRGQCLZIHZ-UHFFFAOYSA-N |
| Molecular Weight | 408.070 g/mol |
| SMILES | C1=C(C=CC(=C1)C(N(CCCCCCCCC)CCCCCCCCC)=O)Cl |