| SpectraBase Compound ID | J4SYkT9GfGh |
|---|---|
| InChI | InChI=1S/C14H11BrO/c15-14-3-1-2-13(9-14)8-11-4-6-12(10-16)7-5-11/h1-7,9-10H,8H2 |
| InChIKey | YZKRACKIPJLWFP-UHFFFAOYSA-N |
| Mol Weight | 275.14 g/mol |
| Molecular Formula | C14H11BrO |
| Exact Mass | 273.999328 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FfSkNIjanfk |
|---|---|
| Name | 4-(3-Bromobenzyl)benzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.999327973 u |
| Formula | C14H11BrO |
| InChI | InChI=1S/C14H11BrO/c15-14-3-1-2-13(9-14)8-11-4-6-12(10-16)7-5-11/h1-7,9-10H,8H2 |
| InChIKey | YZKRACKIPJLWFP-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC(=CC1)CC=1C=C(C=CC1)Br)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919457 |