| SpectraBase Compound ID | EoezxDKYHQV |
|---|---|
| InChI | InChI=1S/C20H33ClO4/c21-15-8-3-1-2-4-9-16-24-19(22)13-10-14-20(23)25-17-18-11-6-5-7-12-18/h5-6,18H,1-4,7-17H2 |
| InChIKey | UUJAQSUDWFRZOV-UHFFFAOYSA-N |
| Mol Weight | 372.9 g/mol |
| Molecular Formula | C20H33ClO4 |
| Exact Mass | 372.206737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9PgkCcy4H30 |
|---|---|
| Name | Glutaric acid, (cyclohex-3-enyl)methyl 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.206737239 u |
| Formula | C20H33ClO4 |
| InChI | InChI=1S/C20H33ClO4/c21-15-8-3-1-2-4-9-16-24-19(22)13-10-14-20(23)25-17-18-11-6-5-7-12-18/h5-6,18H,1-4,7-17H2 |
| InChIKey | UUJAQSUDWFRZOV-UHFFFAOYSA-N |
| Molecular Weight | 372.933 g/mol |
| SMILES | C(CCC(OCCCCCCCCCl)=O)C(OCC1CC=CCC1)=O |