| SpectraBase Compound ID | BALaLHG46A6 |
|---|---|
| InChI | InChI=1S/C13H16O2/c1-15-13-8-3-2-7-12(13)10-5-4-6-11(14)9-10/h2-3,7-8,10H,4-6,9H2,1H3 |
| InChIKey | ZBOJTUXHTHXTAQ-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C13H16O2 |
| Exact Mass | 204.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KQDqXTbFmHm |
|---|---|
| Name | 3-(2-Methoxyphenyl)-1-cyclohexanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.115029753 u |
| Formula | C13H16O2 |
| InChI | InChI=1S/C13H16O2/c1-15-13-8-3-2-7-12(13)10-5-4-6-11(14)9-10/h2-3,7-8,10H,4-6,9H2,1H3 |
| InChIKey | ZBOJTUXHTHXTAQ-UHFFFAOYSA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | C1(CC(CCC1)C=1C(=CC=CC1)OC)=O |