| SpectraBase Compound ID | FfqaLVUr0Wc |
|---|---|
| InChI | InChI=1S/C22H36ClNO/c1-3-5-6-7-8-9-10-11-12-13-18-24(17-4-2)22(25)20-15-14-16-21(23)19-20/h14-16,19H,3-13,17-18H2,1-2H3 |
| InChIKey | XMODCXDOYPPDJR-UHFFFAOYSA-N |
| Mol Weight | 366.0 g/mol |
| Molecular Formula | C22H36ClNO |
| Exact Mass | 365.248542 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Cl2FT2tfsi |
|---|---|
| Name | Benzamide, 3-chloro-N-propyl-N-dodecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 365.248542482 u |
| Formula | C22H36ClNO |
| InChI | InChI=1S/C22H36ClNO/c1-3-5-6-7-8-9-10-11-12-13-18-24(17-4-2)22(25)20-15-14-16-21(23)19-20/h14-16,19H,3-13,17-18H2,1-2H3 |
| InChIKey | XMODCXDOYPPDJR-UHFFFAOYSA-N |
| Molecular Weight | 365.989 g/mol |
| SMILES | C(N(CCC)CCCCCCCCCCCC)(=O)C=1C=CC=C(Cl)C1 |