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(4Z)-4-(4-tert-Butylbenzylidene)-2-(4-iodophenyl)-1,3-oxazol-5(4H)-one
SpectraBase Compound ID 1DMTuCEptIY
InChI InChI=1S/C20H18INO2/c1-20(2,3)15-8-4-13(5-9-15)12-17-19(23)24-18(22-17)14-6-10-16(21)11-7-14/h4-12H,1-3H3/b17-12-
InChIKey QPIQWDGIVNATFQ-ATVHPVEESA-N
Mol Weight 431.27 g/mol
Molecular Formula C20H18INO2
Exact Mass 431.038224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuGROPBUYYq
Name (4Z)-4-(4-tert-Butylbenzylidene)-2-(4-iodophenyl)-1,3-oxazol-5(4H)-one
CAS Registry Number 331667-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18INO2
InChI InChI=1S/C20H18INO2/c1-20(2,3)15-8-4-13(5-9-15)12-17-19(23)24-18(22-17)14-6-10-16(21)11-7-14/h4-12H,1-3H3/b17-12-
InChIKey QPIQWDGIVNATFQ-ATVHPVEESA-N
Molecular Weight 431.273 g/mol
SMILES C1(c2ccc(I)cc2)=N\C(=C/c2ccc(C(C)(C)C)cc2)C(O1)=O
SPLASH splash10-001i-2390100000-cbc07a859f7ee5f34e56
Synonyms (4Z)-4-(4-tert-butylbenzylidene)-2-(4-iodophenyl)-2-oxazolin-5-one (4Z)-4-[(4-tert-butylphenyl)methylene]-2-(4-iodophenyl)oxazol-5-one (4Z)-4-[(4-tert-butylphenyl)methylidene]-2-(4-iodophenyl)-1,3-oxazol-5-one (4Z)-4-[(4-tert-butylphenyl)methylidene]-2-(4-iodophenyl)-5-oxazolone 4-(4-tert-Butyl-benzylidene)-2-(4-iodo-phenyl)-4H-oxazol-5-one 4-(4-tert-butylbenzylidene)-2-(4-iodophenyl)-1,3-oxazol-5(4H)-one
Wiley ID 1459190