| SpectraBase Compound ID | 7WPdnbgHXZG |
|---|---|
| InChI | InChI=1S/C15H24O/c1-11-8-7-9-12(13(11)16)15(5,6)10-14(2,3)4/h7-9,16H,10H2,1-6H3 |
| InChIKey | DWTBZBLLDLEJMV-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 | 4TrAeXlnzaG |
|---|---|
| Name | 2-Methyl-6-tert-octylphenol |
| 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/c1-11-8-7-9-12(13(11)16)15(5,6)10-14(2,3)4/h7-9,16H,10H2,1-6H3 |
| InChIKey | DWTBZBLLDLEJMV-UHFFFAOYSA-N |
| Molecular Weight | 220.356 g/mol |
| SMILES | C1=C(C(=C(C=C1)C(CC(C)(C)C)(C)C)O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947762 |