| SpectraBase Compound ID | Bb0E9KfDigW |
|---|---|
| InChI | InChI=1S/C18H18O4/c1-12(17(19)13-4-8-15(21-2)9-5-13)18(20)14-6-10-16(22-3)11-7-14/h4-12H,1-3H3 |
| InChIKey | CMPYOIFBFSFCMQ-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C18H18O4 |
| Exact Mass | 298.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6LdwK9YQxF |
|---|---|
| Name | 1,3-bis(4-Methoxyphenyl)-2-methylpropan-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.120509056 u |
| Formula | C18H18O4 |
| InChI | InChI=1S/C18H18O4/c1-12(17(19)13-4-8-15(21-2)9-5-13)18(20)14-6-10-16(22-3)11-7-14/h4-12H,1-3H3 |
| InChIKey | CMPYOIFBFSFCMQ-UHFFFAOYSA-N |
| SMILES | C=1(C=CC(=CC1)OC)C(=O)C(C(C1=CC=C(C=C1)OC)=O)C |