| SpectraBase Compound ID | 7qpomEQZw5v |
|---|---|
| InChI | InChI=1S/C14H22O/c1-12(8-6-7-9-13(2)15)14-10-4-3-5-11-14/h3-5,10-13,15H,6-9H2,1-2H3 |
| InChIKey | QEPBEZFQWCFLQZ-UHFFFAOYSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DgXDEvK8i1 |
|---|---|
| Name | 7-Phenyl-octan-2-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.167065327 u |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-12(8-6-7-9-13(2)15)14-10-4-3-5-11-14/h3-5,10-13,15H,6-9H2,1-2H3 |
| InChIKey | QEPBEZFQWCFLQZ-UHFFFAOYSA-N |
| Molecular Weight | 206.329 g/mol |
| SMILES | C1=CC(=CC=C1)C(C)CCCCC(C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.802564 |