| SpectraBase Compound ID | ICBuu6x4JRs |
|---|---|
| InChI | InChI=1S/C16H18O/c1-2-13(12-17)15-8-10-16(11-9-15)14-6-4-3-5-7-14/h3-11,13,17H,2,12H2,1H3 |
| InChIKey | FTNBNTXBMWVFAZ-UHFFFAOYSA-N |
| Mol Weight | 226.32 g/mol |
| Molecular Formula | C16H18O |
| Exact Mass | 226.135765 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5Swy3CCTS0M |
|---|---|
| Name | beta-Ethyl-4-biphenylethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.135765199 u |
| Formula | C16H18O |
| InChI | InChI=1S/C16H18O/c1-2-13(12-17)15-8-10-16(11-9-15)14-6-4-3-5-7-14/h3-11,13,17H,2,12H2,1H3 |
| InChIKey | FTNBNTXBMWVFAZ-UHFFFAOYSA-N |
| Molecular Weight | 226.319 g/mol |
| SMILES | OCC(C=1C=CC(=CC1)C1=CC=CC=C1)CC |
| Spectrum/Structure Validation Score (Raman) | 0.991276 |