| SpectraBase Compound ID | 8P9WlWjo1I3 |
|---|---|
| InChI | InChI=1S/C11H16O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9,11-12H,3H2,1-2H3 |
| InChIKey | XYYQWQIEEXLXDX-UHFFFAOYSA-N |
| Mol Weight | 164.25 g/mol |
| Molecular Formula | C11H16O |
| Exact Mass | 164.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3OxSihaHQn3 |
|---|---|
| Name | 2-Methyl-1-phenyl-1-butanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 164.120115134 u |
| Formula | C11H16O |
| InChI | InChI=1S/C11H16O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h4-9,11-12H,3H2,1-2H3 |
| InChIKey | XYYQWQIEEXLXDX-UHFFFAOYSA-N |
| Molecular Weight | 164.248 g/mol |
| SMILES | C1=CC=CC=C1C(C(CC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956276 |