| SpectraBase Compound ID | Key92mH3bvx |
|---|---|
| InChI | InChI=1S/C19H26O4/c1-2-15-9-6-10-17(13-15)23-19(21)12-11-18(20)22-14-16-7-4-3-5-8-16/h6,9-10,13,16H,2-5,7-8,11-12,14H2,1H3 |
| InChIKey | PMWRUXMKRUAJTK-UHFFFAOYSA-N |
| Mol Weight | 318.41 g/mol |
| Molecular Formula | C19H26O4 |
| Exact Mass | 318.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BGzLhQZO9BU |
|---|---|
| Name | Succinic acid, cyclohexylmethyl 3-ethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.183109313 u |
| Formula | C19H26O4 |
| InChI | InChI=1S/C19H26O4/c1-2-15-9-6-10-17(13-15)23-19(21)12-11-18(20)22-14-16-7-4-3-5-8-16/h6,9-10,13,16H,2-5,7-8,11-12,14H2,1H3 |
| InChIKey | PMWRUXMKRUAJTK-UHFFFAOYSA-N |
| Molecular Weight | 318.413 g/mol |
| SMILES | C(CC(OCC1CCCCC1)=O)C(OC1=CC(=CC=C1)CC)=O |