| SpectraBase Compound ID | ECd5skBPvM1 |
|---|---|
| InChI | InChI=1S/C11H14BrF/c1-2-8-11(13,9-12)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 |
| InChIKey | GLGIYNPTHDWOLY-UHFFFAOYSA-N |
| Mol Weight | 245.14 g/mol |
| Molecular Formula | C11H14BrF |
| Exact Mass | 244.026292 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9KCtFPIMDtj |
|---|---|
| Name | 1-Bromo-2-fluoro-2-phenylpentane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.026291614 u |
| Formula | C11H14BrF |
| InChI | InChI=1S/C11H14BrF/c1-2-8-11(13,9-12)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 |
| InChIKey | GLGIYNPTHDWOLY-UHFFFAOYSA-N |
| Molecular Weight | 245.135 g/mol |
| SMILES | C(C(CCC)(C=1C=CC=CC1)F)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916781 |