| SpectraBase Compound ID | 3VTZ5unoD8D |
|---|---|
| InChI | InChI=1S/C13H14O4/c1-8-4-10(14)13-11(16-3)5-9(15-2)6-12(13)17-7-8/h4-6H,7H2,1-3H3 |
| InChIKey | UZDCRBQWWDMSNA-UHFFFAOYSA-N |
| Mol Weight | 234.25 g/mol |
| Molecular Formula | C13H14O4 |
| Exact Mass | 234.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BsCuOkFYjmD |
|---|---|
| Name | 6,8-Dimethoxy-3-methyl-1-benzoxepin-5(2H)-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14O4 |
| InChI | InChI=1S/C13H14O4/c1-8-4-10(14)13-11(16-3)5-9(15-2)6-12(13)17-7-8/h4-6H,7H2,1-3H3 |
| InChIKey | UZDCRBQWWDMSNA-UHFFFAOYSA-N |
| Molecular Weight | 234.251 g/mol |
| SMILES | c12C(C=C(C)COc2cc(cc1OC)OC)=O |
| SPLASH | splash10-053u-0390000000-579e4caf866e65440b70 |
| Source of Spectrum | H-59-685-23 |
| Wiley ID | 1235874 |