| SpectraBase Compound ID | HBEtf5SoqsB |
|---|---|
| InChI | InChI=1S/C17H25ClO2/c1-2-3-4-5-6-7-8-9-14-20-17(19)15-10-12-16(18)13-11-15/h10-13H,2-9,14H2,1H3 |
| InChIKey | ASTUITNORCWJGQ-UHFFFAOYSA-N |
| Mol Weight | 296.84 g/mol |
| Molecular Formula | C17H25ClO2 |
| Exact Mass | 296.154308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BRuaWbattxl |
|---|---|
| Name | 4-Chlorobenzoic acid, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.154307743 u |
| Formula | C17H25ClO2 |
| InChI | InChI=1S/C17H25ClO2/c1-2-3-4-5-6-7-8-9-14-20-17(19)15-10-12-16(18)13-11-15/h10-13H,2-9,14H2,1H3 |
| InChIKey | ASTUITNORCWJGQ-UHFFFAOYSA-N |
| SMILES | CCCCCCCCCCOC(=O)C=1C=CC(Cl)=CC1 |