| SpectraBase Compound ID | 3e5qZjmxta2 |
|---|---|
| InChI | InChI=1S/C11H18/c1-5-8-11(4,9-6-2)10-7-3/h5-7H,1-3,8-10H2,4H3 |
| InChIKey | IKHJJRGGLISWKM-UHFFFAOYSA-N |
| Mol Weight | 150.26 g/mol |
| Molecular Formula | C11H18 |
| Exact Mass | 150.140851 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ho0WdI7CXhO |
|---|---|
| Name | 4-Methyl-4-prop-2-enyl-hepta-1,6-diene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.140850580 u |
| Formula | C11H18 |
| InChI | InChI=1S/C11H18/c1-5-8-11(4,9-6-2)10-7-3/h5-7H,1-3,8-10H2,4H3 |
| InChIKey | IKHJJRGGLISWKM-UHFFFAOYSA-N |
| Molecular Weight | 150.265 g/mol |
| SMILES | C=CCC(CC=C)(C)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9239 |