| SpectraBase Compound ID | 9RfgAzPIQHg |
|---|---|
| InChI | InChI=1S/C21H40O4/c1-4-6-8-9-14-18-24-20(22)16-12-10-13-17-21(23)25-19(3)15-11-7-5-2/h19H,4-18H2,1-3H3 |
| InChIKey | FVRFHVXGPODYGF-UHFFFAOYSA-N |
| Mol Weight | 356.5 g/mol |
| Molecular Formula | C21H40O4 |
| Exact Mass | 356.29266 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3X5SjvN5I69 |
|---|---|
| Name | Pimelic acid, hept-2-yl heptyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H40O4 |
| InChI | InChI=1S/C21H40O4/c1-4-6-8-9-14-18-24-20(22)16-12-10-13-17-21(23)25-19(3)15-11-7-5-2/h19H,4-18H2,1-3H3 |
| InChIKey | FVRFHVXGPODYGF-UHFFFAOYSA-N |
| Molecular Weight | 356.547 g/mol |
| SMILES | C(CCCCCC(OC(CCCCC)C)=O)(OCCCCCCC)=O |
| SPLASH | splash10-0006-8910000000-cdfb37ad5275c3694670 |
| Source of Spectrum | TIPS-2022-982-0 |
| Wiley ID | 1822499 |