| SpectraBase Compound ID | 2xpq9O7IFWO |
|---|---|
| InChI | InChI=1S/C10H11BrO2/c11-9-4-2-8(3-5-9)10-12-6-1-7-13-10/h2-5,10H,1,6-7H2 |
| InChIKey | HMXWGZTXWOBGOC-UHFFFAOYSA-N |
| Mol Weight | 243.1 g/mol |
| Molecular Formula | C10H11BrO2 |
| Exact Mass | 241.994243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AH6u81plE22 |
|---|---|
| Name | 2-(4-Bromophenyl)-1,3-dioxane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.994242592 u |
| Formula | C10H11BrO2 |
| InChI | InChI=1S/C10H11BrO2/c11-9-4-2-8(3-5-9)10-12-6-1-7-13-10/h2-5,10H,1,6-7H2 |
| InChIKey | HMXWGZTXWOBGOC-UHFFFAOYSA-N |
| Molecular Weight | 243.100 g/mol |
| SMILES | C1(C2=CC=C(C=C2)Br)OCCCO1 |