| SpectraBase Compound ID | BD8WtPwyh0P |
|---|---|
| InChI | InChI=1S/C12H20/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-4H,5-12H2/b3-1-,4-2+ |
| InChIKey | RZUNIXAGSKNOIB-HSFFGMMNSA-N |
| Mol Weight | 164.29 g/mol |
| Molecular Formula | C12H20 |
| Exact Mass | 164.156501 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2oxEnA5jNqH |
|---|---|
| Name | 1,3-Cyclododecadiene, (E,Z)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.156500644 u |
| Formula | C12H20 |
| InChI | InChI=1S/C12H20/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-4H,5-12H2/b3-1-,4-2+ |
| InChIKey | RZUNIXAGSKNOIB-HSFFGMMNSA-N |
| Molecular Weight | 164.292 g/mol |
| SMILES | C1CCCC\C=C/C=C/CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851136 |