| SpectraBase Compound ID | ED08Wehkusm |
|---|---|
| InChI | InChI=1S/C13H24/c1-4-5-6-7-8-9-10-11-12-13(2)3/h10-12H,4-9H2,1-3H3/b11-10+ |
| InChIKey | PQFZRMBYDHGKKP-ZHACJKMWSA-N |
| Mol Weight | 180.33 g/mol |
| Molecular Formula | C13H24 |
| Exact Mass | 180.187801 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | APgmHKDvYuM |
|---|---|
| Name | 2-Methyl-2,4-dodecadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.187800773 u |
| Formula | C13H24 |
| InChI | InChI=1S/C13H24/c1-4-5-6-7-8-9-10-11-12-13(2)3/h10-12H,4-9H2,1-3H3/b11-10+ |
| InChIKey | PQFZRMBYDHGKKP-ZHACJKMWSA-N |
| Molecular Weight | 180.335 g/mol |
| SMILES | CC(=C\C=C\CCCCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915631 |