| SpectraBase Compound ID | Ela3e5yd7VQ |
|---|---|
| InChI | InChI=1S/C10H15ClO3/c1-2-8-13-10(12)14-9-6-4-3-5-7-11/h1H,3-9H2 |
| InChIKey | IZHCNUGVLNNLSV-UHFFFAOYSA-N |
| Mol Weight | 218.68 g/mol |
| Molecular Formula | C10H15ClO3 |
| Exact Mass | 218.070972 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ALG9el9NMmP |
|---|---|
| Name | Carbonic acid, 6-chlorohexyl propargyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.070972040 u |
| Formula | C10H15ClO3 |
| InChI | InChI=1S/C10H15ClO3/c1-2-8-13-10(12)14-9-6-4-3-5-7-11/h1H,3-9H2 |
| InChIKey | IZHCNUGVLNNLSV-UHFFFAOYSA-N |
| Molecular Weight | 218.680 g/mol |
| SMILES | C(OCCCCCCCl)(OCC#C)=O |