| SpectraBase Compound ID | Gh16i8e8MsU |
|---|---|
| InChI | InChI=1S/C15H11Br/c16-10-12-9-11-5-1-2-6-13(11)15-8-4-3-7-14(12)15/h1-9H,10H2 |
| InChIKey | CSZYFOWZUOIKKY-UHFFFAOYSA-N |
| Mol Weight | 271.16 g/mol |
| Molecular Formula | C15H11Br |
| Exact Mass | 270.004413 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IS9xc8Ll9bO |
|---|---|
| Name | Phenanthrene, 9-(bromomethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.004413354 u |
| Formula | C15H11Br |
| InChI | InChI=1S/C15H11Br/c16-10-12-9-11-5-1-2-6-13(11)15-8-4-3-7-14(12)15/h1-9H,10H2 |
| InChIKey | CSZYFOWZUOIKKY-UHFFFAOYSA-N |
| SMILES | C1=CC=C2C(=C1)C=C(CBr)C1=CC=CC=C21 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.885802 |