| SpectraBase Compound ID | 3JofJ19psWx |
|---|---|
| InChI | InChI=1S/C12H18O/c1-10(2)8-13-9-12-7-5-4-6-11(12)3/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | AGMKJVWUFNHRFZ-UHFFFAOYSA-N |
| Mol Weight | 178.27 g/mol |
| Molecular Formula | C12H18O |
| Exact Mass | 178.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8M4RULVzVwE |
|---|---|
| Name | (2-Methylphenyl) methanol, 2-methylpropyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.135765199 u |
| Formula | C12H18O |
| InChI | InChI=1S/C12H18O/c1-10(2)8-13-9-12-7-5-4-6-11(12)3/h4-7,10H,8-9H2,1-3H3 |
| InChIKey | AGMKJVWUFNHRFZ-UHFFFAOYSA-N |
| Molecular Weight | 178.275 g/mol |
| SMILES | C1(=CC=CC=C1COCC(C)C)C |