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(R)-4-Cyano-4-(3,4-dichloro-phenyl)-6-oxo-hexanoic acid methyl ester
SpectraBase Compound ID H5LJzDCZyBZ
InChI InChI=1S/C14H13Cl2NO3/c1-20-13(19)4-5-14(9-17,6-7-18)10-2-3-11(15)12(16)8-10/h2-3,7-8H,4-6H2,1H3/t14-/m0/s1
InChIKey TZEZWTSOPPOQMU-AWEZNQCLSA-N
Mol Weight 314.17 g/mol
Molecular Formula C14H13Cl2NO3
Exact Mass 313.027249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 692ClCECMcK
Name (R)-4-Cyano-4-(3,4-dichloro-phenyl)-6-oxo-hexanoic acid methyl ester
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Formula C14H13Cl2NO3
InChI InChI=1S/C14H13Cl2NO3/c1-20-13(19)4-5-14(9-17,6-7-18)10-2-3-11(15)12(16)8-10/h2-3,7-8H,4-6H2,1H3/t14-/m0/s1
InChIKey TZEZWTSOPPOQMU-AWEZNQCLSA-N
Molecular Weight 314.168 g/mol
SMILES C(#N)[C@](c1cc(Cl)c(cc1)Cl)(CCC(=O)OC)CC=O
SPLASH splash10-03dj-0391000000-1de27d17c3f546d28cd3
Source of Spectrum KC-57-8200-5
Synonyms Methyl (4R)-4-cyano-4-(3,4-dichlorophenyl)-6-oxohexanoate Methyl 4-cyano-4-(3',4'-dichlorophenyl)-6-oxohexanoate
Wiley ID 1625963