| SpectraBase Compound ID | 6vt1lSpRBiO |
|---|---|
| InChI | InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3,6,8H,1,4-5,7,9-12H2,2H3/b8-6- |
| InChIKey | NXAAKAVSSNVOKK-VURMDHGXSA-N |
| Mol Weight | 166.31 g/mol |
| Molecular Formula | C12H22 |
| Exact Mass | 166.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4iIw1Jn7RUr |
|---|---|
| Name | Z-1,9-Dodecadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.172150708 u |
| Formula | C12H22 |
| InChI | InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3,6,8H,1,4-5,7,9-12H2,2H3/b8-6- |
| InChIKey | NXAAKAVSSNVOKK-VURMDHGXSA-N |
| Molecular Weight | 166.308 g/mol |
| SMILES | C=CCCCCCC\C=C/CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.882488 |