| SpectraBase Compound ID | iHWql6o01X |
|---|---|
| InChI | InChI=1S/C19H32O4/c1-15(17-10-5-6-11-17)23-19(21)13-7-12-18(20)22-14-16-8-3-2-4-9-16/h15-17H,2-14H2,1H3 |
| InChIKey | SOGGQQDJRAWKGI-UHFFFAOYSA-N |
| Mol Weight | 324.5 g/mol |
| Molecular Formula | C19H32O4 |
| Exact Mass | 324.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BIlDMMKgv4d |
|---|---|
| Name | Glutaric acid, 1-cyclopentylethyl cyclohexylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.230059506 u |
| Formula | C19H32O4 |
| InChI | InChI=1S/C19H32O4/c1-15(17-10-5-6-11-17)23-19(21)13-7-12-18(20)22-14-16-8-3-2-4-9-16/h15-17H,2-14H2,1H3 |
| InChIKey | SOGGQQDJRAWKGI-UHFFFAOYSA-N |
| Molecular Weight | 324.461 g/mol |
| SMILES | C(CCC(OCC1CCCCC1)=O)C(OC(C)C1CCCC1)=O |