| SpectraBase Compound ID | HCLIAAqeWbM |
|---|---|
| InChI | InChI=1S/C13H20O2/c1-3-4-5-6-11-15-13-9-7-12(14-2)8-10-13/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | LQRHNABGYMNVQL-UHFFFAOYSA-N |
| Mol Weight | 208.3 g/mol |
| Molecular Formula | C13H20O2 |
| Exact Mass | 208.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4wpMHIZKHFk |
|---|---|
| Name | Hexyl 4-methoxyphenyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.146329882 u |
| Formula | C13H20O2 |
| InChI | InChI=1S/C13H20O2/c1-3-4-5-6-11-15-13-9-7-12(14-2)8-10-13/h7-10H,3-6,11H2,1-2H3 |
| InChIKey | LQRHNABGYMNVQL-UHFFFAOYSA-N |
| Molecular Weight | 208.301 g/mol |
| SMILES | C(OC1=CC=C(C=C1)OC)CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942068 |