| SpectraBase Compound ID | LGBlsl9n1qQ |
|---|---|
| InChI | InChI=1S/C12H21ClO2/c13-9-5-1-2-6-10-15-12(14)11-7-3-4-8-11/h11H,1-10H2 |
| InChIKey | IXOYGSOAFINFAX-UHFFFAOYSA-N |
| Mol Weight | 232.75 g/mol |
| Molecular Formula | C12H21ClO2 |
| Exact Mass | 232.123008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9hd2AVn21kQ |
|---|---|
| Name | Cyclopentanecarboxylic acid, 6-chlorohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.123007614 u |
| Formula | C12H21ClO2 |
| InChI | InChI=1S/C12H21ClO2/c13-9-5-1-2-6-10-15-12(14)11-7-3-4-8-11/h11H,1-10H2 |
| InChIKey | IXOYGSOAFINFAX-UHFFFAOYSA-N |
| Molecular Weight | 232.751 g/mol |
| SMILES | C(C1CCCC1)(=O)OCCCCCCCl |