| SpectraBase Compound ID | 35NCMY9IViU |
|---|---|
| InChI | InChI=1S/C23H44O4/c1-7-8-9-10-11-12-14-20(3)27-22(25)16-13-15-21(24)26-18-19(2)17-23(4,5)6/h19-20H,7-18H2,1-6H3 |
| InChIKey | XAKZPYDEKSDIKV-UHFFFAOYSA-N |
| Mol Weight | 384.6 g/mol |
| Molecular Formula | C23H44O4 |
| Exact Mass | 384.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DggHFBH6BTs |
|---|---|
| Name | Glutaric acid, dec-2-yl 2,4,4-trimethylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.323959893 u |
| Formula | C23H44O4 |
| InChI | InChI=1S/C23H44O4/c1-7-8-9-10-11-12-14-20(3)27-22(25)16-13-15-21(24)26-18-19(2)17-23(4,5)6/h19-20H,7-18H2,1-6H3 |
| InChIKey | XAKZPYDEKSDIKV-UHFFFAOYSA-N |
| Molecular Weight | 384.601 g/mol |
| SMILES | C(CCC(OC(CCCCCCCC)C)=O)C(OCC(CC(C)(C)C)C)=O |