| SpectraBase Compound ID | 34zMdVpCMYb |
|---|---|
| InChI | InChI=1S/C19H34O4/c1-14(2)19(15(3)4)23-18(21)12-8-11-17(20)22-13-16-9-6-5-7-10-16/h14-16,19H,5-13H2,1-4H3 |
| InChIKey | YZKQHJSZAPRAPY-UHFFFAOYSA-N |
| Mol Weight | 326.5 g/mol |
| Molecular Formula | C19H34O4 |
| Exact Mass | 326.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2e2yp00YRIk |
|---|---|
| Name | Glutaric acid, cyclohexylmethyl 2,4-dimethylpent-3-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 326.245709571 u |
| Formula | C19H34O4 |
| InChI | InChI=1S/C19H34O4/c1-14(2)19(15(3)4)23-18(21)12-8-11-17(20)22-13-16-9-6-5-7-10-16/h14-16,19H,5-13H2,1-4H3 |
| InChIKey | YZKQHJSZAPRAPY-UHFFFAOYSA-N |
| Molecular Weight | 326.477 g/mol |
| SMILES | C(CCC(OCC1CCCCC1)=O)C(OC(C(C)C)C(C)C)=O |