| SpectraBase Compound ID | F9uwopHx3df |
|---|---|
| InChI | InChI=1S/C12H15F/c1-10(2)4-3-5-11-6-8-12(13)9-7-11/h6-9H,1,3-5H2,2H3 |
| InChIKey | HSVNFFIGTORYFE-UHFFFAOYSA-N |
| Mol Weight | 178.25 g/mol |
| Molecular Formula | C12H15F |
| Exact Mass | 178.115779 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H1wdowZ48Wd |
|---|---|
| Name | Benzene, 1-fluoro-4-(4-methyl-4-pentenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.115778646 u |
| Formula | C12H15F |
| InChI | InChI=1S/C12H15F/c1-10(2)4-3-5-11-6-8-12(13)9-7-11/h6-9H,1,3-5H2,2H3 |
| InChIKey | HSVNFFIGTORYFE-UHFFFAOYSA-N |
| Molecular Weight | 178.250 g/mol |
| SMILES | C(CC1=CC=C(C=C1)F)CC(C)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969201 |