| SpectraBase Compound ID | 4r2tsTLJMKw |
|---|---|
| InChI | InChI=1S/C13H20O/c1-3-4-5-6-7-12-8-10-13(14-2)11-9-12/h8-11H,3-7H2,1-2H3 |
| InChIKey | IAINKDPTJUTRFY-UHFFFAOYSA-N |
| Mol Weight | 192.3 g/mol |
| Molecular Formula | C13H20O |
| Exact Mass | 192.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GGct2oBY2Zj |
|---|---|
| Name | 4-Hexylanisole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.151415263 u |
| Formula | C13H20O |
| InChI | InChI=1S/C13H20O/c1-3-4-5-6-7-12-8-10-13(14-2)11-9-12/h8-11H,3-7H2,1-2H3 |
| InChIKey | IAINKDPTJUTRFY-UHFFFAOYSA-N |
| Molecular Weight | 192.302 g/mol |
| SMILES | C1=C(OC)C=CC(=C1)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.945357 |