| SpectraBase Spectrum ID |
5CPACM6oqWQ |
| Name |
3-Methoxy-2-(phenylethynyl)-5-(phenylmethyl)-2,5-cyclohexadiene-1,4-dione |
| Alternate Name(s) |
5-Benzyl-3-methoxy-2-(phenylethynyl)benzo-1,4-quinone |
| CAS Registry Number |
124603-16-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H16O3 |
| InChI |
InChI=1S/C22H16O3/c1-25-22-19(13-12-16-8-4-2-5-9-16)20(23)15-18(21(22)24)14-17-10-6-3-7-11-17/h2-11,15H,14H2,1H3 |
| InChIKey |
QKCFXQQGJKFDDY-UHFFFAOYSA-N |
| Molecular Weight |
328.367 g/mol |
| SMILES |
C1(=C(C(=O)C(=CC1=O)Cc1ccccc1)OC)C#Cc1ccccc1 |
| SPLASH |
splash10-016u-2921000000-8a25a0392a17282a43b5 |
| Source of Spectrum |
C-112-1903-11 |
| Wiley ID |
1326728 |
