| SpectraBase Compound ID | 6K2jQBQB3l4 |
|---|---|
| InChI | InChI=1S/C11H12O/c1-2-3-6-10-7-4-5-8-11(10)9-12/h3-5,7-8,12H,1,6,9H2 |
| InChIKey | NWPSWXSNQHHLEP-UHFFFAOYSA-N |
| Mol Weight | 160.22 g/mol |
| Molecular Formula | C11H12O |
| Exact Mass | 160.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6YPy7zTlzzS |
|---|---|
| Name | (2-Buta-2,3-dienylphenyl)methanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.088815005 u |
| Formula | C11H12O |
| InChI | InChI=1S/C11H12O/c1-2-3-6-10-7-4-5-8-11(10)9-12/h3-5,7-8,12H,1,6,9H2 |
| InChIKey | NWPSWXSNQHHLEP-UHFFFAOYSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C(=C=C)CC=1C(CO)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938882 |