| SpectraBase Compound ID | HOc86Gl4Gdw |
|---|---|
| InChI | InChI=1S/C11H20O/c1-6-11(4,12-5)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3 |
| InChIKey | BARWQAWUANUTNS-UHFFFAOYSA-N |
| Mol Weight | 168.28 g/mol |
| Molecular Formula | C11H20O |
| Exact Mass | 168.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2h2cnaGvY5D |
|---|---|
| Name | Linalool, methyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.151415263 u |
| Formula | C11H20O |
| InChI | InChI=1S/C11H20O/c1-6-11(4,12-5)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3 |
| InChIKey | BARWQAWUANUTNS-UHFFFAOYSA-N |
| Molecular Weight | 168.280 g/mol |
| SMILES | CC(=CCCC(C=C)(OC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96474 |