| SpectraBase Compound ID | BTblGmT36nX |
|---|---|
| InChI | InChI=1S/C19H34O4/c1-3-5-12-17(9-4-2)23-19(21)14-13-18(20)22-15-16-10-7-6-8-11-16/h16-17H,3-15H2,1-2H3 |
| InChIKey | KQBZLNGYJQJZFT-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 | 6M4oAiCjgKL |
|---|---|
| Name | Succinic acid, cyclohexylmethyl 4-octyl 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/c1-3-5-12-17(9-4-2)23-19(21)14-13-18(20)22-15-16-10-7-6-8-11-16/h16-17H,3-15H2,1-2H3 |
| InChIKey | KQBZLNGYJQJZFT-UHFFFAOYSA-N |
| Molecular Weight | 326.477 g/mol |
| SMILES | C(CC(OCC1CCCCC1)=O)C(OC(CCCC)CCC)=O |