| SpectraBase Compound ID | IyUm095xUzh |
|---|---|
| InChI | InChI=1S/C14H22/c1-3-4-8-13(2)11-12-14-9-6-5-7-10-14/h14H,2-10H2,1H3 |
| InChIKey | RQBICXKVHONSOM-UHFFFAOYSA-N |
| Mol Weight | 190.33 g/mol |
| Molecular Formula | C14H22 |
| Exact Mass | 190.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EcTYwc3vo3l |
|---|---|
| Name | Cyclohexane, (3-methylene-1-heptynyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.172150708 u |
| Formula | C14H22 |
| InChI | InChI=1S/C14H22/c1-3-4-8-13(2)11-12-14-9-6-5-7-10-14/h14H,2-10H2,1H3 |
| InChIKey | RQBICXKVHONSOM-UHFFFAOYSA-N |
| Molecular Weight | 190.330 g/mol |
| SMILES | C(#CC1CCCCC1)C(=C)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.893308 |