| SpectraBase Compound ID | 6HUhs0wNQn2 |
|---|---|
| InChI | InChI=1S/C12H11BrO/c1-14-12-7-6-9-4-2-3-5-10(9)11(12)8-13/h2-7H,8H2,1H3 |
| InChIKey | FITUXDWDCPOBIX-UHFFFAOYSA-N |
| Mol Weight | 251.12 g/mol |
| Molecular Formula | C12H11BrO |
| Exact Mass | 249.999328 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HBygfBppWGU |
|---|---|
| Name | 1-Bromomethyl-2-methoxynaphthalene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.999327973 u |
| Formula | C12H11BrO |
| InChI | InChI=1S/C12H11BrO/c1-14-12-7-6-9-4-2-3-5-10(9)11(12)8-13/h2-7H,8H2,1H3 |
| InChIKey | FITUXDWDCPOBIX-UHFFFAOYSA-N |
| Molecular Weight | 251.123 g/mol |
| SMILES | C1(=C2C(C=CC=C2)=CC=C1OC)CBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851014 |