| SpectraBase Compound ID | 91TUdEl3ceP |
|---|---|
| InChI | InChI=1S/C22H42O4/c1-4-7-8-9-10-14-19-25-21(23)17-12-11-13-18-22(24)26-20(15-5-2)16-6-3/h20H,4-19H2,1-3H3 |
| InChIKey | GQJHNEISJNNYCA-UHFFFAOYSA-N |
| Mol Weight | 370.6 g/mol |
| Molecular Formula | C22H42O4 |
| Exact Mass | 370.30831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CK7RifNrBab |
|---|---|
| Name | Pimelic acid, 4-heptyl octyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H42O4 |
| InChI | InChI=1S/C22H42O4/c1-4-7-8-9-10-14-19-25-21(23)17-12-11-13-18-22(24)26-20(15-5-2)16-6-3/h20H,4-19H2,1-3H3 |
| InChIKey | GQJHNEISJNNYCA-UHFFFAOYSA-N |
| Molecular Weight | 370.574 g/mol |
| SMILES | C(CCCCCC(OC(CCC)CCC)=O)(OCCCCCCCC)=O |
| SPLASH | splash10-052f-7920000000-cf66362f16722ebcb91d |
| Source of Spectrum | TIPS-2022-825-0 |
| Wiley ID | 1822342 |