| SpectraBase Compound ID | JgJub9YwaSs |
|---|---|
| InChI | InChI=1S/C18H14O2S/c1-13-18(15-10-6-3-7-11-15)20-17(19)12-16(21-13)14-8-4-2-5-9-14/h2-12H,1H3 |
| InChIKey | KXXXHFKPHWUTPY-UHFFFAOYSA-N |
| Mol Weight | 294.37 g/mol |
| Molecular Formula | C18H14O2S |
| Exact Mass | 294.071451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ASa9nZ93km7 |
|---|---|
| Name | 3-Methyl-2,5-diphenyl-1,4-oxathiepin-7-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H14O2S |
| InChI | InChI=1S/C18H14O2S/c1-13-18(15-10-6-3-7-11-15)20-17(19)12-16(21-13)14-8-4-2-5-9-14/h2-12H,1H3 |
| InChIKey | KXXXHFKPHWUTPY-UHFFFAOYSA-N |
| Molecular Weight | 294.368 g/mol |
| SMILES | C=1(SC(=C(c2ccccc2)OC(C1)=O)C)c1ccccc1 |
| SPLASH | splash10-0a4i-0930000000-932b7a24eac5a5b08775 |
| Source of Spectrum | AT-42-4640-11 |
| Wiley ID | 855162 |