| SpectraBase Compound ID | GsfR5lPAVpo |
|---|---|
| InChI | InChI=1S/C16H22O3/c1-2-3-4-5-6-7-13-8-9-15-16(10-13)19-12-14(17)11-18-15/h8-10H,2-7,11-12H2,1H3 |
| InChIKey | FYXIUUJQDCHVSF-UHFFFAOYSA-N |
| Mol Weight | 262.35 g/mol |
| Molecular Formula | C16H22O3 |
| Exact Mass | 262.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BbHQupiQE9U |
|---|---|
| Name | 7-Heptyl-1,5-benzodioxepin-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22O3 |
| InChI | InChI=1S/C16H22O3/c1-2-3-4-5-6-7-13-8-9-15-16(10-13)19-12-14(17)11-18-15/h8-10H,2-7,11-12H2,1H3 |
| InChIKey | FYXIUUJQDCHVSF-UHFFFAOYSA-N |
| Molecular Weight | 262.349 g/mol |
| SMILES | c12OCC(COc2ccc(c1)CCCCCCC)=O |
| SPLASH | splash10-004i-1930000000-3df0a87748d3f59bc7cb |
| Source of Spectrum | K1-2003-3741-23 |
| Wiley ID | 1521530 |