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4-(2'-Chlorotetrafluoroethyl)methyl-3(E)-(1'-Iidoethylidene)-1-tosyl-2(3H)-dihydropyrrolidone
SpectraBase Compound ID DO1YxookmvM
InChI InChI=1S/C16H15ClF4INO3S/c1-9-3-5-12(6-4-9)27(25,26)23-8-11(13(10(2)22)14(23)24)7-15(18,19)16(17,20)21/h3-6,11H,7-8H2,1-2H3/b13-10+
InChIKey KFULJLZBTFFYSU-JLHYYAGUSA-N
Mol Weight 539.71 g/mol
Molecular Formula C16H15ClF4INO3S
Exact Mass 538.9442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tOGTBfH0wj
Name 4-(2'-Chlorotetrafluoroethyl)methyl-3(E)-(1'-Iidoethylidene)-1-tosyl-2(3H)-dihydropyrrolidone
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Formula C16H15ClF4INO3S
InChI InChI=1S/C16H15ClF4INO3S/c1-9-3-5-12(6-4-9)27(25,26)23-8-11(13(10(2)22)14(23)24)7-15(18,19)16(17,20)21/h3-6,11H,7-8H2,1-2H3/b13-10+
InChIKey KFULJLZBTFFYSU-JLHYYAGUSA-N
Molecular Weight 539.711 g/mol
SMILES c1(S(N2C(\C(=C/(I)C)C(C2)CC(C(F)(F)Cl)(F)F)=O)(=O)=O)ccc(cc1)C
SPLASH splash10-06r6-9600400000-910c4f7ff2ac7a5de5b9
Source of Spectrum F-51-2657-17
Synonyms 4-(2'-Chlorotetrafluoroethyl)methyl-3(E)-(1'-idoethylidene)-1-tosyl-2(3H)-dihydropyrrolidone
Wiley ID 791163