| SpectraBase Spectrum ID |
4jI42agXheg |
| Name |
1H-2-Benzoxocin-4,5-dicarboxylic acid, 1-oxo-3,6-diphenyl-, dimethyl ester |
| CAS Registry Number |
106976-68-5 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20O6 |
| InChI |
InChI=1S/C27H20O6/c1-31-26(29)22-21(17-11-5-3-6-12-17)19-15-9-10-16-20(19)25(28)33-24(23(22)27(30)32-2)18-13-7-4-8-14-18/h3-16H,1-2H3/b22-21+,24-23+ |
| InChIKey |
FOYRFEMLCAMPLH-RLPYSRNMSA-N |
| Molecular Weight |
440.451 g/mol |
| SMILES |
c12\C(=C/(\C(=C\(OC(c1cccc2)=O)c1ccccc1)C(=O)OC)C(=O)OC)c1ccccc1 |
| SPLASH |
splash10-0a4i-0901500000-be02d395f9f57b149c96 |
| Source of Spectrum |
J-52-1087-4 |
| Synonyms |
3-Oxa-4,7-diphenyl-5,6-dimethylcarbonyl-bicyclo[6.4.0]dodecan-4,6,9,11,8(1)pentaen-2-one
Dimethyl 1-oxo-3,6-diphenyl-1H-2-benzoxocin-4,5-dicarboxylate |
| Wiley ID |
1384792 |
