| SpectraBase Compound ID | IQGTlNtPF6J |
|---|---|
| InChI | InChI=1S/C11H22/c1-6-10(4)7-8-11(5)9(2)3/h7-11H,6H2,1-5H3/b8-7+ |
| InChIKey | BPHPRVXZLWQTOR-BQYQJAHWSA-N |
| Mol Weight | 154.3 g/mol |
| Molecular Formula | C11H22 |
| Exact Mass | 154.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9txBRw9XQfO |
|---|---|
| Name | 4-Octene, 2,3,6-trimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.172150708 u |
| Formula | C11H22 |
| InChI | InChI=1S/C11H22/c1-6-10(4)7-8-11(5)9(2)3/h7-11H,6H2,1-5H3/b8-7+ |
| InChIKey | BPHPRVXZLWQTOR-BQYQJAHWSA-N |
| Molecular Weight | 154.297 g/mol |
| SMILES | C(\C=C\C(C(C)C)C)(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.949857 |