| SpectraBase Compound ID | 1a6WyoOBTJo |
|---|---|
| InChI | InChI=1S/C18H34O4/c1-4-7-15-21-17(19)13-9-8-10-14-18(20)22-16(11-5-2)12-6-3/h16H,4-15H2,1-3H3 |
| InChIKey | BKJGXUBXEYHDOK-UHFFFAOYSA-N |
| Mol Weight | 314.5 g/mol |
| Molecular Formula | C18H34O4 |
| Exact Mass | 314.24571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9aPYx04IbrM |
|---|---|
| Name | Pimelic acid, 4-heptyl butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H34O4 |
| InChI | InChI=1S/C18H34O4/c1-4-7-15-21-17(19)13-9-8-10-14-18(20)22-16(11-5-2)12-6-3/h16H,4-15H2,1-3H3 |
| InChIKey | BKJGXUBXEYHDOK-UHFFFAOYSA-N |
| Molecular Weight | 314.466 g/mol |
| SMILES | C(CCCCCC(OC(CCC)CCC)=O)(OCCCC)=O |
| SPLASH | splash10-054p-5900000000-9ae5608a1c8a7976b3b6 |
| Source of Spectrum | TIPS-2022-821-0 |
| Wiley ID | 1822338 |