| SpectraBase Compound ID | 7pDirhQhO5L |
|---|---|
| InChI | InChI=1S/C21H40O5/c1-5-6-7-8-9-10-11-16-25-20(22)13-12-14-21(23)26-19(3)18(2)15-17-24-4/h18-19H,5-17H2,1-4H3 |
| InChIKey | PZOMOKMZQVEMNT-UHFFFAOYSA-N |
| Mol Weight | 372.5 g/mol |
| Molecular Formula | C21H40O5 |
| Exact Mass | 372.287574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Yajm0rTNAF |
|---|---|
| Name | Glutaric acid, 5-methoxy-3-methylpent-2-yl nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.287574383 u |
| Formula | C21H40O5 |
| InChI | InChI=1S/C21H40O5/c1-5-6-7-8-9-10-11-16-25-20(22)13-12-14-21(23)26-19(3)18(2)15-17-24-4/h18-19H,5-17H2,1-4H3 |
| InChIKey | PZOMOKMZQVEMNT-UHFFFAOYSA-N |
| Molecular Weight | 372.546 g/mol |
| SMILES | CC(OC(=O)CCCC(OCCCCCCCCC)=O)C(CCOC)C |