| SpectraBase Compound ID | 5uKnpOKoAbv |
|---|---|
| InChI | InChI=1S/C16H30O5/c1-12(2)11-20-15(17)7-6-8-16(18)21-14(4)13(3)9-10-19-5/h12-14H,6-11H2,1-5H3 |
| InChIKey | ZURSDWSLCIXXBH-UHFFFAOYSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C16H30O5 |
| Exact Mass | 302.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7JfOiYOsBt |
|---|---|
| Name | Glutaric acid, isobutyl 5-methoxy-3-methylpent-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.209324061 u |
| Formula | C16H30O5 |
| InChI | InChI=1S/C16H30O5/c1-12(2)11-20-15(17)7-6-8-16(18)21-14(4)13(3)9-10-19-5/h12-14H,6-11H2,1-5H3 |
| InChIKey | ZURSDWSLCIXXBH-UHFFFAOYSA-N |
| SMILES | CC(OC(=O)CCCC(=O)OCC(C)C)C(CCOC)C |