| SpectraBase Compound ID | B5MlKNFy6Vk |
|---|---|
| InChI | InChI=1S/C12H20/c1-6-7-12-10(4)8(2)9(3)11(12)5/h8H,6-7H2,1-5H3 |
| InChIKey | ICLCEVZDOKYXJZ-UHFFFAOYSA-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 | 8xvemQaWwJB |
|---|---|
| Name | 1,2,4,5-Tetramethyl-3-propyl-cyclopenta-1,3-diene |
| 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/c1-6-7-12-10(4)8(2)9(3)11(12)5/h8H,6-7H2,1-5H3 |
| InChIKey | ICLCEVZDOKYXJZ-UHFFFAOYSA-N |
| Molecular Weight | 164.292 g/mol |
| SMILES | C=1(C(=C(C)C(C1C)C)CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965012 |