| SpectraBase Compound ID | BKXjb5w80dl |
|---|---|
| InChI | InChI=1S/C15H26Cl2O4/c16-10-4-2-8-14(18)20-12-6-1-7-13-21-15(19)9-3-5-11-17/h1-13H2 |
| InChIKey | HGBBGQAZZKBYFA-UHFFFAOYSA-N |
| Mol Weight | 341.28 g/mol |
| Molecular Formula | C15H26Cl2O4 |
| Exact Mass | 340.120815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C3ZiWtOsMIm |
|---|---|
| Name | 1,5-Pentanediol, o,o'-di(5-chlorovaleryl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.120814713 u |
| Formula | C15H26Cl2O4 |
| InChI | InChI=1S/C15H26Cl2O4/c16-10-4-2-8-14(18)20-12-6-1-7-13-21-15(19)9-3-5-11-17/h1-13H2 |
| InChIKey | HGBBGQAZZKBYFA-UHFFFAOYSA-N |
| Molecular Weight | 341.275 g/mol |
| SMILES | C(OCCCCCOC(CCCCCl)=O)(CCCCCl)=O |