| SpectraBase Compound ID | Ja5RPE7NPUO |
|---|---|
| InChI | InChI=1S/C16H23ClO2/c1-2-3-4-5-6-7-10-13-19-16(18)14-11-8-9-12-15(14)17/h8-9,11-12H,2-7,10,13H2,1H3 |
| InChIKey | DTONOUJAHINTOZ-UHFFFAOYSA-N |
| Mol Weight | 282.81 g/mol |
| Molecular Formula | C16H23ClO2 |
| Exact Mass | 282.138658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9UxfGeGWlBd |
|---|---|
| Name | 2-Chlorobenzoic acid, nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.138657679 u |
| Formula | C16H23ClO2 |
| InChI | InChI=1S/C16H23ClO2/c1-2-3-4-5-6-7-10-13-19-16(18)14-11-8-9-12-15(14)17/h8-9,11-12H,2-7,10,13H2,1H3 |
| InChIKey | DTONOUJAHINTOZ-UHFFFAOYSA-N |
| SMILES | C(OCCCCCCCCC)(=O)C=1C=CC=CC1Cl |