| SpectraBase Compound ID | DRZMmxYJsNy |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-8-3-4-10-9(5-8)6-12(2,7-13)11(10)14/h3-5,13H,6-7H2,1-2H3 |
| InChIKey | GWIILMGVMBOMGQ-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3IEEONCRtDx |
|---|---|
| Name | 2,5-Dimethyl-2-methylol-indan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-8-3-4-10-9(5-8)6-12(2,7-13)11(10)14/h3-5,13H,6-7H2,1-2H3 |
| InChIKey | GWIILMGVMBOMGQ-UHFFFAOYSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C1(C(C=2C=CC(=CC2C1)C)=O)(CO)C |