| SpectraBase Compound ID | CpsoB8JHfwL |
|---|---|
| InChI | InChI=1S/C14H19ClN2O3/c1-2-3-4-5-6-7-14(18)16-11-8-9-13(17(19)20)12(15)10-11/h8-10H,2-7H2,1H3,(H,16,18) |
| InChIKey | UAKAWWKFQDHBQN-UHFFFAOYSA-N |
| Mol Weight | 298.77 g/mol |
| Molecular Formula | C14H19ClN2O3 |
| Exact Mass | 298.10842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7rGIMxMsUxW |
|---|---|
| Name | 3'-Chloro-4'-nitrooctananilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.108420177 u |
| Formula | C14H19ClN2O3 |
| InChI | InChI=1S/C14H19ClN2O3/c1-2-3-4-5-6-7-14(18)16-11-8-9-13(17(19)20)12(15)10-11/h8-10H,2-7H2,1H3,(H,16,18) |
| InChIKey | UAKAWWKFQDHBQN-UHFFFAOYSA-N |
| Molecular Weight | 298.770 g/mol |
| SMILES | N(C1=CC=C(C(=C1)Cl)N(=O)=O)C(CCCCCCC)=O |