| SpectraBase Compound ID | 7m30xB4su0C |
|---|---|
| InChI | InChI=1S/C22H42O4/c1-5-8-9-10-11-12-16-19(4)25-21(23)17-13-18-22(24)26-20(14-6-2)15-7-3/h19-20H,5-18H2,1-4H3 |
| InChIKey | UVYDFRDOSAOEAJ-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 | BNEqR0oMK6n |
|---|---|
| Name | Glutaric acid, 2-decyl hept-4-yl 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/c1-5-8-9-10-11-12-16-19(4)25-21(23)17-13-18-22(24)26-20(14-6-2)15-7-3/h19-20H,5-18H2,1-4H3 |
| InChIKey | UVYDFRDOSAOEAJ-UHFFFAOYSA-N |
| Molecular Weight | 370.574 g/mol |
| SMILES | C(CCC(OC(CCC)CCC)=O)C(OC(C)CCCCCCCC)=O |