| SpectraBase Compound ID | LoPhRkna5Ot |
|---|---|
| InChI | InChI=1S/C15H24O/c1-5-6-11-16-12-13-7-9-14(10-8-13)15(2,3)4/h7-10H,5-6,11-12H2,1-4H3 |
| InChIKey | KFGAOEXGDLGNGR-UHFFFAOYSA-N |
| Mol Weight | 220.36 g/mol |
| Molecular Formula | C15H24O |
| Exact Mass | 220.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4OosWvMCIMS |
|---|---|
| Name | Butyl 4-tert-butylbenzyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.182715392 u |
| Formula | C15H24O |
| InChI | InChI=1S/C15H24O/c1-5-6-11-16-12-13-7-9-14(10-8-13)15(2,3)4/h7-10H,5-6,11-12H2,1-4H3 |
| InChIKey | KFGAOEXGDLGNGR-UHFFFAOYSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | C(OCCCC)C=1C=CC(=CC1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967443 |