| SpectraBase Compound ID | EnHRUoBOdaE |
|---|---|
| InChI | InChI=1S/C12H14O2/c13-11-6-2-1-4-9(11)8-10-5-3-7-12(10)14/h1-2,4,6,10,13H,3,5,7-8H2 |
| InChIKey | LTHWTRFHLIKMIY-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 | DWyJohY9sbS |
|---|---|
| Name | 2-Hydroxyphenylmethyl-1-cyclopentanone |
| 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/c13-11-6-2-1-4-9(11)8-10-5-3-7-12(10)14/h1-2,4,6,10,13H,3,5,7-8H2 |
| InChIKey | LTHWTRFHLIKMIY-UHFFFAOYSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(C=1C(O)=CC=CC1)C1C(=O)CCC1 |