| SpectraBase Compound ID | 8UfrcITnAXH |
|---|---|
| InChI | InChI=1S/C27H51ClO4/c1-2-3-4-5-6-7-9-12-15-18-24-31-26(29)21-20-22-27(30)32-25-19-16-13-10-8-11-14-17-23-28/h2-25H2,1H3 |
| InChIKey | PGAJZLBKBFRPEW-UHFFFAOYSA-N |
| Mol Weight | 475.2 g/mol |
| Molecular Formula | C27H51ClO4 |
| Exact Mass | 474.347588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8OMrVauFY1m |
|---|---|
| Name | Glutaric acid, 10-chlorodecyl dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 474.347587818 u |
| Formula | C27H51ClO4 |
| InChI | InChI=1S/C27H51ClO4/c1-2-3-4-5-6-7-9-12-15-18-24-31-26(29)21-20-22-27(30)32-25-19-16-13-10-8-11-14-17-23-28/h2-25H2,1H3 |
| InChIKey | PGAJZLBKBFRPEW-UHFFFAOYSA-N |
| Molecular Weight | 475.154 g/mol |
| SMILES | CCCCCCCCCCCCOC(CCCC(OCCCCCCCCCCCl)=O)=O |