| SpectraBase Compound ID | Fzb3tup2yl2 |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-5-6-12-19-15(17)10-8-7-9-11-16(18)20-14(4)13(2)3/h13-14H,5-12H2,1-4H3 |
| InChIKey | TYFRMIGNPWHLJP-UHFFFAOYSA-N |
| Mol Weight | 286.41 g/mol |
| Molecular Formula | C16H30O4 |
| Exact Mass | 286.214409 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4IsP2Kr4hHq |
|---|---|
| Name | Pimelic acid, 3-methylbut-2-yl butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H30O4 |
| InChI | InChI=1S/C16H30O4/c1-5-6-12-19-15(17)10-8-7-9-11-16(18)20-14(4)13(2)3/h13-14H,5-12H2,1-4H3 |
| InChIKey | TYFRMIGNPWHLJP-UHFFFAOYSA-N |
| Molecular Weight | 286.412 g/mol |
| SMILES | C(CCCCCC(OC(C(C)C)C)=O)(OCCCC)=O |
| SPLASH | splash10-002f-7900000000-341ba26ad0c0418ec301 |
| Source of Spectrum | TIPS-2022-999-0 |
| Wiley ID | 1822516 |