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3-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid ethyl ester
SpectraBase Compound ID 9QxnxXCKZ6O
InChI InChI=1S/C19H19ClN2O5/c1-3-27-18(23)11-17(13-6-4-12(2)5-7-13)21-19(24)15-9-8-14(22(25)26)10-16(15)20/h4-10,17H,3,11H2,1-2H3,(H,21,24)
InChIKey GYKFGAQGPVNVEA-UHFFFAOYSA-N
Mol Weight 390.82 g/mol
Molecular Formula C19H19ClN2O5
Exact Mass 390.098249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmUUtmPSSTZ
Name 3-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid ethyl ester
Alternate Name(s) Ethyl 3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-3-(4-methylphenyl)propanoate Ethyl 3-[(2-chloro-4-nitro-benzoyl)amino]-3-(p-tolyl)propanoate Ethyl 3-[(2-chloro-4-nitrobenzoyl)amino]-3-(4-methylphenyl)propanoate
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Formula C19H19ClN2O5
InChI InChI=1S/C19H19ClN2O5/c1-3-27-18(23)11-17(13-6-4-12(2)5-7-13)21-19(24)15-9-8-14(22(25)26)10-16(15)20/h4-10,17H,3,11H2,1-2H3,(H,21,24)
InChIKey GYKFGAQGPVNVEA-UHFFFAOYSA-N
Molecular Weight 390.823 g/mol
SMILES N(C(c1ccc(cc1)C)CC(OCC)=O)C(=O)c1c(cc(cc1)N(=O)=O)Cl
SPLASH splash10-0a4i-0592000000-8f73f41c2c15c5dd3b6e
Wiley ID 1511702