| SpectraBase Compound ID | FuGnTn9sA2G |
|---|---|
| InChI | InChI=1S/C14H25IO/c1-3-5-6-7-8-10-13-14(15)12(9-4-2)11-16-13/h13H,3-11H2,1-2H3 |
| InChIKey | FVAJJDLBHNZVNN-UHFFFAOYSA-N |
| Mol Weight | 336.26 g/mol |
| Molecular Formula | C14H25IO |
| Exact Mass | 336.09501 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EnIWwuOCXcS |
|---|---|
| Name | 2-Heptyl-3-iodo-4-propyl-2,5-dihydrofuran |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.095010424 u |
| Formula | C14H25IO |
| InChI | InChI=1S/C14H25IO/c1-3-5-6-7-8-10-13-14(15)12(9-4-2)11-16-13/h13H,3-11H2,1-2H3 |
| InChIKey | FVAJJDLBHNZVNN-UHFFFAOYSA-N |
| Molecular Weight | 336.257 g/mol |
| SMILES | C1(OCC(=C1I)CCC)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946171 |