SpectraBase Spectrum ID |
6WSZCEFpiZY |
Name |
Diethyl (E)-3-benzoyl-4-(but-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 |
370.178023932 u |
Formula |
C22H26O5 |
InChI |
InChI=1S/C22H26O5/c1-4-7-11-17-14-22(20(24)26-5-2,21(25)27-6-3)15-18(17)19(23)16-12-9-8-10-13-16/h7-13H,4-6,14-15H2,1-3H3/b11-7+ |
InChIKey |
OIUQZRJPPUUFPF-YRNVUSSQSA-N |
Instrument Name |
Finnigan SSQ or 7000 Thermo Deca XP |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201503293 |
Molecular Weight |
370.445 g/mol |
Quality |
67 |
Reported Formula |
C22H26O5 |
SMILES |
C(C)OC(=O)C1(CC(=C(C1)\C=C\CC)C(C1=CC=CC=C1)=O)C(=O)OCC |
SPLASH |
splash10-0a6r-5900000000-f77388ba25dbf6b88b86 |
Sample Comments |
E/Z = 99:1 |
Source of Spectrum |
QE-21-SM19-6i (DOI: 10.1002/chem.201503293) |
Wiley ID |
1907289 |