| SpectraBase Compound ID | 5XiVxgV19Fo |
|---|---|
| InChI | InChI=1S/C16H16O2/c1-3-7-14(8-4-1)16(11-12-17-13-18-16)15-9-5-2-6-10-15/h1-10H,11-13H2 |
| InChIKey | QZEPQXVJPWLYIX-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C16H16O2 |
| Exact Mass | 240.11503 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FGQhZqEHa75 |
|---|---|
| Name | 4,4-Diphenyl-m-dioxane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.115029753 u |
| Formula | C16H16O2 |
| InChI | InChI=1S/C16H16O2/c1-3-7-14(8-4-1)16(11-12-17-13-18-16)15-9-5-2-6-10-15/h1-10H,11-13H2 |
| InChIKey | QZEPQXVJPWLYIX-UHFFFAOYSA-N |
| Molecular Weight | 240.302 g/mol |
| SMILES | C1C(OCOC1)(C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.997778 |