| SpectraBase Compound ID | B4KUphUsMsD |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-9(11(2,3)12)13-10-7-5-4-6-8-10/h4-9,12H,1-3H3 |
| InChIKey | CZSNYFGOSVUFRC-UHFFFAOYSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LDISErr4yJR |
|---|---|
| Name | 2-Methyl-3-phenoxybutan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-9(11(2,3)12)13-10-7-5-4-6-8-10/h4-9,12H,1-3H3 |
| InChIKey | CZSNYFGOSVUFRC-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C(C(OC1=CC=CC=C1)C)(O)(C)C |