| SpectraBase Spectrum ID |
EJ2bIhcIClD |
| Name |
Diethyl (E/Z)-3-benzoyl-4-(4-methoxystyryl)cyclopent-3-ene-1,1-dicarboxylate |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.188588616 u |
| Formula |
C27H28O6 |
| InChI |
InChI=1S/C27H28O6/c1-4-32-25(29)27(26(30)33-5-2)17-21(14-11-19-12-15-22(31-3)16-13-19)23(18-27)24(28)20-9-7-6-8-10-20/h6-16H,4-5,17-18H2,1-3H3 |
| InChIKey |
JAQOBSUVDBILMO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ or 7000 Thermo Deca XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201503293 |
| Molecular Weight |
448.515 g/mol |
| Quality |
38 |
| Reported Formula |
C27H28O6 |
| SMILES |
C(C)OC(=O)C1(CC(=C(C1)C=CC1=CC=C(C=C1)OC)C(C1=CC=CC=C1)=O)C(=O)OCC |
| SPLASH |
splash10-0a4i-2900000000-14da63feff41c325c5db |
| Sample Comments |
E/Z = 99:1 |
| Source of Spectrum |
QE-21-SM18-6f (DOI: 10.1002/chem.201503293) |
| Wiley ID |
1907287 |
