| SpectraBase Compound ID | 6mjQotla7Ed |
|---|---|
| InChI | InChI=1S/C12H21ClO2/c1-10(11-6-2-3-7-11)15-12(14)8-4-5-9-13/h10-11H,2-9H2,1H3 |
| InChIKey | VRDDNVHSUKRPQS-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 | GKMcqA3muoa |
|---|---|
| Name | 5-Chloropentanoic acid, 1-(cyclopentyl)ethyl 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/c1-10(11-6-2-3-7-11)15-12(14)8-4-5-9-13/h10-11H,2-9H2,1H3 |
| InChIKey | VRDDNVHSUKRPQS-UHFFFAOYSA-N |
| Molecular Weight | 232.751 g/mol |
| SMILES | C1(CCCC1)C(OC(CCCCCl)=O)C |