| SpectraBase Compound ID | 9F8Lc4EP3pT |
|---|---|
| InChI | InChI=1S/C16H15BrO/c1-12(18)16(17)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,18H,1H3 |
| InChIKey | AMAGXFLRBLOURV-UHFFFAOYSA-N |
| Mol Weight | 303.2 g/mol |
| Molecular Formula | C16H15BrO |
| Exact Mass | 302.030628 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BeUklPhuCjZ |
|---|---|
| Name | 3-Bromo-4,4-diphenyl-3-buten-2-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.030628102 u |
| Formula | C16H15BrO |
| InChI | InChI=1S/C16H15BrO/c1-12(18)16(17)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,18H,1H3 |
| InChIKey | AMAGXFLRBLOURV-UHFFFAOYSA-N |
| SMILES | C(=C(C(O)C)Br)(C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.894834 |