| SpectraBase Compound ID | KEAJcfe9v25 |
|---|---|
| InChI | InChI=1S/C22H42O4/c1-5-7-9-10-11-13-16-20(4)26-22(24)18-14-17-21(23)25-19(3)15-12-8-6-2/h19-20H,5-18H2,1-4H3 |
| InChIKey | HPZAGKARIVDANU-UHFFFAOYSA-N |
| Mol Weight | 370.6 g/mol |
| Molecular Formula | C22H42O4 |
| Exact Mass | 370.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GxwoR2HCx3h |
|---|---|
| Name | Glutaric acid, hept-2-yl 2-decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.308309828 u |
| Formula | C22H42O4 |
| InChI | InChI=1S/C22H42O4/c1-5-7-9-10-11-13-16-20(4)26-22(24)18-14-17-21(23)25-19(3)15-12-8-6-2/h19-20H,5-18H2,1-4H3 |
| InChIKey | HPZAGKARIVDANU-UHFFFAOYSA-N |
| Molecular Weight | 370.574 g/mol |
| SMILES | C(CCC(OC(C)CCCCC)=O)C(OC(CCCCCCCC)C)=O |