| SpectraBase Compound ID | LybC9F2hJaH |
|---|---|
| InChI | InChI=1S/C5H9Br/c1-3-4-5(2)6/h3-5H,1-2H3/b4-3+ |
| InChIKey | LIPODSDLKCMVON-ONEGZZNKSA-N |
| Mol Weight | 149.03 g/mol |
| Molecular Formula | C5H9Br |
| Exact Mass | 147.988763 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9Q8180UtOGE |
|---|---|
| Name | 2-Pentene, 4-bromo- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.988763290 u |
| Formula | C5H9Br |
| InChI | InChI=1S/C5H9Br/c1-3-4-5(2)6/h3-5H,1-2H3/b4-3+ |
| InChIKey | LIPODSDLKCMVON-ONEGZZNKSA-N |
| Molecular Weight | 149.031 g/mol |
| SMILES | C(\C=C\C)(Br)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973489 |