| SpectraBase Compound ID | JrUj9SbMCYo |
|---|---|
| InChI | InChI=1S/C17H33ClO2/c1-2-3-4-5-8-11-14-17(19)20-16-13-10-7-6-9-12-15-18/h2-16H2,1H3 |
| InChIKey | APFJCMJBKSBOSO-UHFFFAOYSA-N |
| Mol Weight | 304.9 g/mol |
| Molecular Formula | C17H33ClO2 |
| Exact Mass | 304.216908 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQUh6BVf8uO |
|---|---|
| Name | Nonanoic acid, 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.216908001 u |
| Formula | C17H33ClO2 |
| InChI | InChI=1S/C17H33ClO2/c1-2-3-4-5-8-11-14-17(19)20-16-13-10-7-6-9-12-15-18/h2-16H2,1H3 |
| InChIKey | APFJCMJBKSBOSO-UHFFFAOYSA-N |
| Molecular Weight | 304.902 g/mol |
| SMILES | C(Cl)CCCCCCCOC(CCCCCCCC)=O |