| SpectraBase Compound ID | 6gbJ4WrV390 |
|---|---|
| InChI | InChI=1S/C28H53ClO4/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-25-32-27(30)22-21-23-28(31)33-26-20-17-14-12-15-18-24-29/h2-26H2,1H3 |
| InChIKey | VCMAKVUVCGDVPL-UHFFFAOYSA-N |
| Mol Weight | 489.2 g/mol |
| Molecular Formula | C28H53ClO4 |
| Exact Mass | 488.363238 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JjPsd7JXlSH |
|---|---|
| Name | Glutaric acid, 8-chlorooctyl pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 488.363237883 u |
| Formula | C28H53ClO4 |
| InChI | InChI=1S/C28H53ClO4/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-25-32-27(30)22-21-23-28(31)33-26-20-17-14-12-15-18-24-29/h2-26H2,1H3 |
| InChIKey | VCMAKVUVCGDVPL-UHFFFAOYSA-N |
| Molecular Weight | 489.181 g/mol |
| SMILES | CCCCCCCCCCCCCCCOC(CCCC(OCCCCCCCCCl)=O)=O |