| SpectraBase Compound ID | 3UA04jNCvAw |
|---|---|
| InChI | InChI=1S/C12H16O/c1-8-6-9(2)12(10(3)7-8)13-11-4-5-11/h6-7,11H,4-5H2,1-3H3 |
| InChIKey | RWCYIMWMQLHMDE-UHFFFAOYSA-N |
| Mol Weight | 176.26 g/mol |
| Molecular Formula | C12H16O |
| Exact Mass | 176.120115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9jImvYPXWXx |
|---|---|
| Name | 2,4,6-Trimethylphenylcyclopropylether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.120115134 u |
| Formula | C12H16O |
| InChI | InChI=1S/C12H16O/c1-8-6-9(2)12(10(3)7-8)13-11-4-5-11/h6-7,11H,4-5H2,1-3H3 |
| InChIKey | RWCYIMWMQLHMDE-UHFFFAOYSA-N |
| Molecular Weight | 176.259 g/mol |
| SMILES | C1(OC2=C(C)C=C(C)C=C2C)CC1 |