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.alpha.-(Z)-(1'-Chloroethylene)-cis-.beta.-chloromethyl-.gamma.-phenyl-.gamma.-butyrolactam
SpectraBase Compound ID CLM5yVJoWja
InChI InChI=1S/C13H13Cl2NO/c1-8(15)11-10(7-14)12(16-13(11)17)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3,(H,16,17)/b11-8-/t10-,12-/m1/s1
InChIKey TXWBKNDPFYGFIE-ANRSTRNGSA-N
Mol Weight 270.16 g/mol
Molecular Formula C13H13Cl2NO
Exact Mass 269.037419 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID epnSlzz6fS
Name .alpha.-(Z)-(1'-Chloroethylene)-cis-.beta.-chloromethyl-.gamma.-phenyl-.gamma.-butyrolactam
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Formula C13H13Cl2NO
InChI InChI=1S/C13H13Cl2NO/c1-8(15)11-10(7-14)12(16-13(11)17)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3,(H,16,17)/b11-8-/t10-,12-/m1/s1
InChIKey TXWBKNDPFYGFIE-ANRSTRNGSA-N
Molecular Weight 270.159 g/mol
SMILES N1[C@@]([C@@](\C(C1=O)=C\(Cl)C)(CCl)[H])(c1ccccc1)[H]
SPLASH splash10-0059-0950000000-90b3586f15e7ba34cf98
Source of Spectrum F-52-10953-10
Synonyms (3Z,4R,5S)-3-(1-chloroethylidene)-4-(chloromethyl)-5-phenyl-2-pyrrolidinone (3Z,4R,5S)-3-(1-chloroethylidene)-4-(chloromethyl)-5-phenylpyrrolidin-2-one (3Z,4R,5S)-3-(1-chloroethylidene)-4-(chloromethyl)-5-phenyl-pyrrolidin-2-one (3Z,4R,5S)-3-(1-chloranylethylidene)-4-(chloromethyl)-5-phenyl-pyrrolidin-2-one
Wiley ID 798037