| SpectraBase Compound ID | 6wFrhJtpY2z |
|---|---|
| InChI | InChI=1S/C17H24O3/c1-2-3-4-5-6-7-8-14-9-10-16-17(11-14)20-13-15(18)12-19-16/h9-11H,2-8,12-13H2,1H3 |
| InChIKey | MHCCAHOMANRTPP-UHFFFAOYSA-N |
| Mol Weight | 276.38 g/mol |
| Molecular Formula | C17H24O3 |
| Exact Mass | 276.172545 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5OxXemghX6Z |
|---|---|
| Name | 7-Octyl-1,5-benzodioxepin-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H24O3 |
| InChI | InChI=1S/C17H24O3/c1-2-3-4-5-6-7-8-14-9-10-16-17(11-14)20-13-15(18)12-19-16/h9-11H,2-8,12-13H2,1H3 |
| InChIKey | MHCCAHOMANRTPP-UHFFFAOYSA-N |
| Molecular Weight | 276.376 g/mol |
| SMILES | c12OCC(COc2ccc(c1)CCCCCCCC)=O |
| SPLASH | splash10-004i-1940000000-b9cb22f93d71a1b48140 |
| Source of Spectrum | K1-2003-3741-24 |
| Wiley ID | 1521529 |