| SpectraBase Compound ID | 6VY0p7atszy |
|---|---|
| InChI | InChI=1S/C14H17BrO/c1-16-13-8-7-12-5-2-4-11(6-3-9-15)14(12)10-13/h4,7-8,10H,2-3,5-6,9H2,1H3 |
| InChIKey | GWQCCXRCHNTVDZ-UHFFFAOYSA-N |
| Mol Weight | 281.19 g/mol |
| Molecular Formula | C14H17BrO |
| Exact Mass | 280.046278 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1wexrR9dlZ5 |
|---|---|
| Name | 4-(3-Bromanylpropyl)-6-methoxy-1,2-dihydronaphthalene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.046278166 u |
| Formula | C14H17BrO |
| InChI | InChI=1S/C14H17BrO/c1-16-13-8-7-12-5-2-4-11(6-3-9-15)14(12)10-13/h4,7-8,10H,2-3,5-6,9H2,1H3 |
| InChIKey | GWQCCXRCHNTVDZ-UHFFFAOYSA-N |
| SMILES | C1CC=C(C=2C=C(C=CC12)OC)CCCBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.848616 |