| SpectraBase Compound ID | 26pmQmajpVu |
|---|---|
| InChI | InChI=1S/C12H18O/c1-4-11(3)13-9-12-8-6-5-7-10(12)2/h5-8,11H,4,9H2,1-3H3 |
| InChIKey | VUOKHHXUOHZBSA-UHFFFAOYSA-N |
| Mol Weight | 178.27 g/mol |
| Molecular Formula | C12H18O |
| Exact Mass | 178.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3QGB3CC2Bv9 |
|---|---|
| Name | (2-Methylphenyl) methanol, 1-methylpropyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.135765199 u |
| Formula | C12H18O |
| InChI | InChI=1S/C12H18O/c1-4-11(3)13-9-12-8-6-5-7-10(12)2/h5-8,11H,4,9H2,1-3H3 |
| InChIKey | VUOKHHXUOHZBSA-UHFFFAOYSA-N |
| Molecular Weight | 178.275 g/mol |
| SMILES | C1(=CC=CC=C1COC(CC)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937729 |