| SpectraBase Compound ID | DovrqAXSJt8 |
|---|---|
| InChI | InChI=1S/C14H13Br/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2 |
| InChIKey | BYHXJDDDSHSQKQ-UHFFFAOYSA-N |
| Mol Weight | 261.16 g/mol |
| Molecular Formula | C14H13Br |
| Exact Mass | 260.020063 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | ExGp17iXG0x |
|---|---|
| Name | Benzene, 1-bromo-2-(2-phenylethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.020063419 u |
| Formula | C14H13Br |
| InChI | InChI=1S/C14H13Br/c15-14-9-5-4-8-13(14)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2 |
| InChIKey | BYHXJDDDSHSQKQ-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC=C1)Br)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.995081 |