| SpectraBase Compound ID | 9zmoeCFYT5a |
|---|---|
| InChI | InChI=1S/C14H27FO/c1-3-5-6-7-8-9-10-12-14(16)13(15)11-4-2/h13H,3-12H2,1-2H3 |
| InChIKey | BDCCKNABIPPEHW-UHFFFAOYSA-N |
| Mol Weight | 230.37 g/mol |
| Molecular Formula | C14H27FO |
| Exact Mass | 230.204594 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1SdlyiMCbYi |
|---|---|
| Name | 4-Fluoro-5-tetradecanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.204593651 u |
| Formula | C14H27FO |
| InChI | InChI=1S/C14H27FO/c1-3-5-6-7-8-9-10-12-14(16)13(15)11-4-2/h13H,3-12H2,1-2H3 |
| InChIKey | BDCCKNABIPPEHW-UHFFFAOYSA-N |
| Molecular Weight | 230.367 g/mol |
| SMILES | CCCC(C(CCCCCCCCC)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951012 |