| SpectraBase Compound ID | KUdAM3XCB0W |
|---|---|
| InChI | InChI=1S/C20H22O2/c1-15-7-11-17(12-8-15)19(21)5-3-4-6-20(22)18-13-9-16(2)10-14-18/h7-14H,3-6H2,1-2H3 |
| InChIKey | ONAXVWKDWBEZCL-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 | LmccQKGmnCC |
|---|---|
| Name | 1,6-bis(p-Methylphenyl)-1,6-hexanedione |
| 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/c1-15-7-11-17(12-8-15)19(21)5-3-4-6-20(22)18-13-9-16(2)10-14-18/h7-14H,3-6H2,1-2H3 |
| InChIKey | ONAXVWKDWBEZCL-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC(=CC1)C)(=O)CCCCC(C1=CC=C(C=C1)C)=O |