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METHYL-7,7,7-TRICHLORO-4-PARA-TOLYLAMINO-6-OXO-4-HEPTENOATE
SpectraBase Compound ID G0JL6sjeioO
InChI InChI=1S/C15H16Cl3NO3/c1-10-3-5-11(6-4-10)19-12(7-8-14(21)22-2)9-13(20)15(16,17)18/h3-6,9,19H,7-8H2,1-2H3/b12-9-
InChIKey WRNXOLWFSLGHHZ-XFXZXTDPSA-N
Mol Weight 364.66 g/mol
Molecular Formula C15H16Cl3NO3
Exact Mass 363.019576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BFRiF4YaeHO
Name (Z)-7,7,7-Trichloro-6-oxo-4-p-tolylamino-hept-4-enoic acid methyl ester
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Formula C15H16Cl3NO3
InChI InChI=1S/C15H16Cl3NO3/c1-10-3-5-11(6-4-10)19-12(7-8-14(21)22-2)9-13(20)15(16,17)18/h3-6,9,19H,7-8H2,1-2H3/b12-9-
InChIKey WRNXOLWFSLGHHZ-XFXZXTDPSA-N
Molecular Weight 364.656 g/mol
SMILES N(\C(=C/C(C(Cl)(Cl)Cl)=O)CCC(=O)OC)c1ccc(C)cc1
SPLASH splash10-03dj-2390000000-d8a72f3efd7d09551600
Source of Spectrum D9-19-190-4e
Synonyms Methyl 4-[N-(p-tolyl)amino]-6-oxo-7,7,7-trifluoro-4-heptenoate
Wiley ID 1695415