![2-[3-(3,6-diketocyclohexa-1,4-dien-1-yl)-2,4-diphenyl-cyclobutyl]-p-benzoquinone](/api/spectrum/11BOmsDZzs/structure.png?h=300&w=458 "2-[3-(3,6-diketocyclohexa-1,4-dien-1-yl)-2,4-diphenyl-cyclobutyl]-p-benzoquinone")
| SpectraBase Compound ID | LBf27g9ds3o |
|---|---|
| InChI | InChI=1S/C28H20O4/c29-19-11-13-23(31)21(15-19)27-25(17-7-3-1-4-8-17)28(22-16-20(30)12-14-24(22)32)26(27)18-9-5-2-6-10-18/h1-16,25-28H |
| InChIKey | BRHHBBLKFCRYAQ-UHFFFAOYSA-N |
| Mol Weight | 420.46 g/mol |
| Molecular Formula | C28H20O4 |
| Exact Mass | 420.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 11BOmsDZzs |
|---|---|
| Name | 2-[3-(3,6-diketocyclohexa-1,4-dien-1-yl)-2,4-diphenyl-cyclobutyl]-p-benzoquinone |
| Alternate Name(s) | 2-[3-(3,6-dioxo-1-cyclohexa-1,4-dienyl)-2,4-diphenylcyclobutyl]cyclohexa-2,5-diene-1,4-dione 2-[3-(3,6-dioxocyclohexa-1,4-dien-1-yl)-2,4-diphenyl-cyclobutyl]-1,4-benzoquinone 2-[3-(3,6-dioxocyclohexa-1,4-dien-1-yl)-2,4-diphenylcyclobutyl]cyclohexa-2,5-diene-1,4-dione 2-[3-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-2,4-diphenyl-cyclobutyl]cyclohexa-2,5-diene-1,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H20O4 |
| InChI | InChI=1S/C28H20O4/c29-19-11-13-23(31)21(15-19)27-25(17-7-3-1-4-8-17)28(22-16-20(30)12-14-24(22)32)26(27)18-9-5-2-6-10-18/h1-16,25-28H |
| InChIKey | BRHHBBLKFCRYAQ-UHFFFAOYSA-N |
| Molecular Weight | 420.464 g/mol |
| SMILES | C1(C2C(c3ccccc3)C(C3=CC(=O)C=CC3=O)C2c2ccccc2)=CC(=O)C=CC1=O |
| SPLASH | splash10-03k9-2390500000-3d880f2ade473463dfd4 |
| Source of Spectrum | U1-1998-623-9 |
| Wiley ID | 750960 |