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(2E,4Z)-4,5-bis(4-chlorophenyl)-6-(phenylthio)hexa-2,4-dienoic acid methyl ester
SpectraBase Compound ID HEu0A6V3tRJ
InChI InChI=1S/C25H20Cl2O2S/c1-29-25(28)16-15-23(18-7-11-20(26)12-8-18)24(19-9-13-21(27)14-10-19)17-30-22-5-3-2-4-6-22/h2-16H,17H2,1H3/b16-15+,24-23+
InChIKey OVDSFSJCRFBCIN-CABHBREESA-N
Mol Weight 455.4 g/mol
Molecular Formula C25H20Cl2O2S
Exact Mass 454.056106 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Y7SROAOtC9
Name (2E,4Z)-4,5-bis(4-chlorophenyl)-6-(phenylthio)hexa-2,4-dienoic acid methyl ester
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Formula C25H20Cl2O2S
InChI InChI=1S/C25H20Cl2O2S/c1-29-25(28)16-15-23(18-7-11-20(26)12-8-18)24(19-9-13-21(27)14-10-19)17-30-22-5-3-2-4-6-22/h2-16H,17H2,1H3/b16-15+,24-23+
InChIKey OVDSFSJCRFBCIN-CABHBREESA-N
Molecular Weight 455.399 g/mol
SMILES C(\C(=C\(\C=C\C(=O)OC)c1ccc(cc1)Cl)c1ccc(cc1)Cl)Sc1ccccc1
SPLASH splash10-00kk-0097500000-2fe08b83e07b31f455f9
Source of Spectrum KC-0-842-14
Synonyms Methyl (2E,4Z)-4,5-bis(4-chlorophenyl)-6-phenylsulfanyl-hexa-2,4-dienoate
Wiley ID 787766