| SpectraBase Compound ID | 1OxH0t7bMvJ |
|---|---|
| InChI | InChI=1S/C10H17ClO4/c1-3-14-9(12)5-4-6-10(13)15-7-8(2)11/h8H,3-7H2,1-2H3 |
| InChIKey | XLGKMUOWQINGHE-UHFFFAOYSA-N |
| Mol Weight | 236.69 g/mol |
| Molecular Formula | C10H17ClO4 |
| Exact Mass | 236.081537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8tSxN3xKipM |
|---|---|
| Name | Glutaric acid, 2-chloropropyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.081536723 u |
| Formula | C10H17ClO4 |
| InChI | InChI=1S/C10H17ClO4/c1-3-14-9(12)5-4-6-10(13)15-7-8(2)11/h8H,3-7H2,1-2H3 |
| InChIKey | XLGKMUOWQINGHE-UHFFFAOYSA-N |
| Molecular Weight | 236.695 g/mol |
| SMILES | CC(COC(CCCC(OCC)=O)=O)Cl |