![3,3-Dimethyl-7-phenyl-[1,2,4]-trioxepane](/api/spectrum/LYnSdh50cxy/structure.png?h=300&w=458 "3,3-Dimethyl-7-phenyl-[1,2,4]-trioxepane")
| SpectraBase Compound ID | HWSqHp2uABS |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-12(2)13-9-8-11(14-15-12)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3 |
| InChIKey | UUKRPABRUMMYMC-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LYnSdh50cxy |
|---|---|
| Name | 3,3-Dimethyl-7-phenyl-[1,2,4]-trioxepane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-12(2)13-9-8-11(14-15-12)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3 |
| InChIKey | UUKRPABRUMMYMC-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C1(OOC(CCO1)c1ccccc1)(C)C |
| SPLASH | splash10-0zfr-0950000000-221ad5c9356cdc1c2f1e |
| Source of Spectrum | AT-39-2774-3 |
| Wiley ID | 854084 |