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E-5-[4-(4-(4-Bromobenzoylmethoxy)phenylmethylene]-1,3-thiazolidin-2,4-dione
SpectraBase Compound ID AG9b97F4nSa
InChI InChI=1S/C18H12BrNO4S/c19-13-5-3-12(4-6-13)15(21)10-24-14-7-1-11(2-8-14)9-16-17(22)20-18(23)25-16/h1-9H,10H2,(H,20,22,23)/b16-9+
InChIKey QREDEQWYBJEGPB-CXUHLZMHSA-N
Mol Weight 418.26 g/mol
Molecular Formula C18H12BrNO4S
Exact Mass 416.967042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRuvkqQJRCJ
Name E-5-[4-(4-(4-Bromobenzoylmethoxy)phenylmethylene]-1,3-thiazolidin-2,4-dione
Appearance Pale yellow crystals
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Formula C18H12BrNO4S
InChI InChI=1S/C18H12BrNO4S/c19-13-5-3-12(4-6-13)15(21)10-24-14-7-1-11(2-8-14)9-16-17(22)20-18(23)25-16/h1-9H,10H2,(H,20,22,23)/b16-9+
InChIKey QREDEQWYBJEGPB-CXUHLZMHSA-N
Instrument Name Shimadzu GC-MS Qp 1000 EX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0007.a01
Molecular Weight 418.261 g/mol
SMILES N1C(\C(SC1=O)=C/c1ccc(cc1)OCC(c1ccc(cc1)Br)=O)=O
SPLASH splash10-114i-2911100000-0bce299ccf4631b3f989
Source of Spectrum ARK-2006-4-5d
Wiley ID 1871095