| SpectraBase Compound ID | BNREkntVypY |
|---|---|
| InChI | InChI=1S/C10H18/c1-5-7-9(3)10(4)8-6-2/h5-10H,1-4H3/b7-5+,8-6+ |
| InChIKey | JASAKDWEYSDIHI-KQQUZDAGSA-N |
| Mol Weight | 138.25 g/mol |
| Molecular Formula | C10H18 |
| Exact Mass | 138.140851 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | APBBCjacQ5I |
|---|---|
| Name | 2,6-Octadiene, 4,5-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.140850580 u |
| Formula | C10H18 |
| InChI | InChI=1S/C10H18/c1-5-7-9(3)10(4)8-6-2/h5-10H,1-4H3/b7-5+,8-6+ |
| InChIKey | JASAKDWEYSDIHI-KQQUZDAGSA-N |
| Molecular Weight | 138.254 g/mol |
| SMILES | C(C(\C=C\C)C)(\C=C\C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962111 |