| SpectraBase Compound ID | Ij5CaIpmFe3 |
|---|---|
| InChI | InChI=1S/C8H15ClO3/c1-11-8(10)12-7-5-3-2-4-6-9/h2-7H2,1H3 |
| InChIKey | SXLFLUNEBCECFY-UHFFFAOYSA-N |
| Mol Weight | 194.66 g/mol |
| Molecular Formula | C8H15ClO3 |
| Exact Mass | 194.070972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L97fyjWh5X2 |
|---|---|
| Name | Carbonic acid, 6-chlorohexyl methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.070972040 u |
| Formula | C8H15ClO3 |
| InChI | InChI=1S/C8H15ClO3/c1-11-8(10)12-7-5-3-2-4-6-9/h2-7H2,1H3 |
| InChIKey | SXLFLUNEBCECFY-UHFFFAOYSA-N |
| Molecular Weight | 194.658 g/mol |
| SMILES | C(OC)(=O)OCCCCCCCl |