| SpectraBase Compound ID | 3mbCmuHLMKd |
|---|---|
| InChI | InChI=1S/C16H9Br/c17-15-9-8-13-11-5-2-1-4-10(11)12-6-3-7-14(15)16(12)13/h1-9H |
| InChIKey | WCXFCLXZMIFHBU-UHFFFAOYSA-N |
| Mol Weight | 281.15 g/mol |
| Molecular Formula | C16H9Br |
| Exact Mass | 279.988763 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3j5CRu7q1mI |
|---|---|
| Name | 3-Bromofluoranthene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.988763290 u |
| Formula | C16H9Br |
| InChI | InChI=1S/C16H9Br/c17-15-9-8-13-11-5-2-1-4-10(11)12-6-3-7-14(15)16(12)13/h1-9H |
| InChIKey | WCXFCLXZMIFHBU-UHFFFAOYSA-N |
| SMILES | C1=CC=2C(=CC=C3C=4C=CC=CC4C(C23)=C1)Br |
| Spectrum/Structure Validation Score (Raman) | 0.926199 |