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Ethyl (E)-2-Phenyliodonio-3-(4-chlorobenzyl)aminocrotonate tosylater
SpectraBase Compound ID 5oKWvyeuHwB
InChI InChI=1S/C18H17ClINO2.C7H8O3S/c1-3-23-18(22)17(20-15-7-5-4-6-8-15)13(2)21-16-11-9-14(19)10-12-16;1-6-2-4-7(5-3-6)11(8,9)10/h4-12H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)
InChIKey OLBKGYPSLJCZTK-UHFFFAOYSA-N
Mol Weight 613.89 g/mol
Molecular Formula C25H25ClINO5S
Exact Mass 613.018667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1mZSOKIFnw
Name Ethyl (E)-2-Phenyliodonio-3-(4-chlorobenzyl)aminocrotonate tosylater
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25ClINO5S
InChI InChI=1S/C18H17ClINO2.C7H8O3S/c1-3-23-18(22)17(20-15-7-5-4-6-8-15)13(2)21-16-11-9-14(19)10-12-16;1-6-2-4-7(5-3-6)11(8,9)10/h4-12H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)
InChIKey OLBKGYPSLJCZTK-UHFFFAOYSA-N
Molecular Weight 613.894 g/mol
SMILES c1(S([O-])(=O)=O)ccc(cc1)C.N(\C(=C/([I+]c1ccccc1)C(=O)OCC)C)c1ccc(cc1)Cl
SPLASH splash10-004i-2900000000-7a6e5c3dae65e192ef45
Source of Spectrum CV-0-390-6
Synonyms (E)-1-Ethoxy-1-oxo-2-phenyliodonio-3-(4-chlorobenzyl)aminobut-2-enyl tosylate salt [(E)-3-(4-chloroanilino)-1-ethoxy-1-oxobut-2-en-2-yl]-phenyliodonium;4-methylbenzenesulfonate [(E)-3-(4-chloroanilino)-1-ethoxy-1-oxobut-2-en-2-yl]-phenyliodanium;4-methylbenzenesulfonate [(E)-2-(4-chloroanilino)-1-ethoxycarbonyl-prop-1-enyl]-phenyl-iodonium;4-methylbenzenesulfonate [(E)-3-[(4-chlorophenyl)amino]-1-ethoxy-1-oxidanylidene-but-2-en-2-yl]-phenyl-iodanium;4-methylbenzenesulfonate
Wiley ID 872639