| SpectraBase Spectrum ID |
75sUq0ZgS1F |
| Name |
Diethyl (E/Z)-3-benzoyl-4-(2-phenylprop-1-en-1-yl)cyclopent-3-ene-1,1-dicarboxylate |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.193673997 u |
| Formula |
C27H28O5 |
| InChI |
InChI=1S/C27H28O5/c1-4-31-25(29)27(26(30)32-5-2)17-22(16-19(3)20-12-8-6-9-13-20)23(18-27)24(28)21-14-10-7-11-15-21/h6-16H,4-5,17-18H2,1-3H3 |
| InChIKey |
ODWPKNWAENADOJ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ or 7000 Thermo Deca XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201503293 |
| Molecular Weight |
432.516 g/mol |
| Quality |
74 |
| Reported Formula |
C27H28O5 |
| SMILES |
C(C)OC(=O)C1(CC(=C(C1)C=C(C)C1=CC=CC=C1)C(C1=CC=CC=C1)=O)C(=O)OCC |
| SPLASH |
splash10-014i-0100900000-5faa76d0e1212122327f |
| Sample Comments |
E/Z = 63:37 |
| Source of Spectrum |
QE-21-SM16-6c (DOI: 10.1002/chem.201503293) |
| Wiley ID |
1907283 |
