| SpectraBase Compound ID | JbO4ZYBXq74 |
|---|---|
| InChI | InChI=1S/C18H34O4/c1-4-6-9-12-16(3)22-18(20)14-11-8-10-13-17(19)21-15-7-5-2/h16H,4-15H2,1-3H3 |
| InChIKey | DAVMKSBSNLKVSV-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 | 5D4Z5BlvCdC |
|---|---|
| Name | Pimelic acid, hept-2-yl butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H34O4 |
| InChI | InChI=1S/C18H34O4/c1-4-6-9-12-16(3)22-18(20)14-11-8-10-13-17(19)21-15-7-5-2/h16H,4-15H2,1-3H3 |
| InChIKey | DAVMKSBSNLKVSV-UHFFFAOYSA-N |
| Molecular Weight | 314.466 g/mol |
| SMILES | C(CCCCCC(OC(CCCCC)C)=O)(OCCCC)=O |
| SPLASH | splash10-054p-6900000000-e247ec8a4a0715acf236 |
| Source of Spectrum | TIPS-2022-979-0 |
| Wiley ID | 1822496 |