| SpectraBase Compound ID | HwXc37VoEbc |
|---|---|
| InChI | InChI=1S/C22H18O4/c1-15-7-11-17(12-8-15)21(23)25-19-5-3-4-6-20(19)26-22(24)18-13-9-16(2)10-14-18/h3-14H,1-2H3 |
| InChIKey | LSNLRVAMPPAGOB-UHFFFAOYSA-N |
| Mol Weight | 346.38 g/mol |
| Molecular Formula | C22H18O4 |
| Exact Mass | 346.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ltw5n0jPFh1 |
|---|---|
| Name | 1,2-Benzenediol, o,o'-di(4-methylbenzoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.120509056 u |
| Formula | C22H18O4 |
| InChI | InChI=1S/C22H18O4/c1-15-7-11-17(12-8-15)21(23)25-19-5-3-4-6-20(19)26-22(24)18-13-9-16(2)10-14-18/h3-14H,1-2H3 |
| InChIKey | LSNLRVAMPPAGOB-UHFFFAOYSA-N |
| Molecular Weight | 346.382 g/mol |
| SMILES | CC1=CC=C(C(OC=2C(=CC=CC2)OC(C2=CC=C(C)C=C2)=O)=O)C=C1 |