SpectraBase Compound ID | 6gnV4hM3nYK |
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InChI | InChI=1S/C15H13BrO/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h1-11H,12H2/b11-10+ |
InChIKey | ZXURXGCQLVFPCX-ZHACJKMWSA-N |
Mol Weight | 289.17 g/mol |
Molecular Formula | C15H13BrO |
Exact Mass | 288.014978 g/mol |
SpectraBase Spectrum ID | Ld6ZUgcE8Z5 |
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Name | (E)-.beta.-Bromo-4-benzyloxystyrene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 288.014978038 u |
Formula | C15H13BrO |
InChI | InChI=1S/C15H13BrO/c16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h1-11H,12H2/b11-10+ |
InChIKey | ZXURXGCQLVFPCX-ZHACJKMWSA-N |
SMILES | C1(\C=C\Br)=CC=C(OCC2=CC=CC=C2)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921764 |