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Ethyl (E,Z)-2-((4-oxo-5-(2-oxo-2-phenylethylidene)-1-phenyl-4,5-dihydro-1H-imidazol-2-yl)thio)acetate
SpectraBase Compound ID 958OGKfOUPi
InChI InChI=1S/C21H18N2O4S/c1-2-27-19(25)14-28-21-22-20(26)17(23(21)16-11-7-4-8-12-16)13-18(24)15-9-5-3-6-10-15/h3-13H,2,14H2,1H3
InChIKey AVWNVUJIPJELTN-UHFFFAOYSA-N
Mol Weight 394.45 g/mol
Molecular Formula C21H18N2O4S
Exact Mass 394.098728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QkQhNGSZ6
Name Ethyl (E,Z)-2-((4-oxo-5-(2-oxo-2-phenylethylidene)-1-phenyl-4,5-dihydro-1H-imidazol-2-yl)thio)acetate
Appearance Pale yellow crystals
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Formula C21H18N2O4S
InChI InChI=1S/C21H18N2O4S/c1-2-27-19(25)14-28-21-22-20(26)17(23(21)16-11-7-4-8-12-16)13-18(24)15-9-5-3-6-10-15/h3-13H,2,14H2,1H3
InChIKey AVWNVUJIPJELTN-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3871
Molecular Weight 394.445 g/mol
SMILES C(C)OC(CSC=1N(C(C(N1)=O)=CC(c1ccccc1)=O)c1ccccc1)=O
SPLASH splash10-0a6u-4964000000-e05267c05741be614438
Sample Comments (E/Z)-Mixture
Source of Spectrum Y-57-SM50-6a
Wiley ID 1860117