| SpectraBase Compound ID | 6M6seqCRnR4 |
|---|---|
| InChI | InChI=1S/C20H22O2/c1-19(2)12-17(21)20(3,18(22)13-19)11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10H,11-13H2,1-3H3 |
| InChIKey | GJTYRCSNOOPBFV-UHFFFAOYSA-N |
| Mol Weight | 294.39 g/mol |
| Molecular Formula | C20H22O2 |
| Exact Mass | 294.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EZVajAPyvBw |
|---|---|
| Name | 2-(1-Naphthylmethyl)-2,5,5-trimethyl-1,3-cyclohexanedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.161979946 u |
| Formula | C20H22O2 |
| InChI | InChI=1S/C20H22O2/c1-19(2)12-17(21)20(3,18(22)13-19)11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10H,11-13H2,1-3H3 |
| InChIKey | GJTYRCSNOOPBFV-UHFFFAOYSA-N |
| SMILES | C1=CC=2C(=CC=CC2C=C1)CC1(C(CC(C)(C)CC1=O)=O)C |