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5-(4-Chlorophenyl)-2-methyl-2-(4-nitrophenyl)-5-oxopentanoic acid ethyl ester
SpectraBase Compound ID EaF4OmBL90C
InChI InChI=1S/C20H20ClNO5/c1-3-27-19(24)20(2,15-6-10-17(11-7-15)22(25)26)13-12-18(23)14-4-8-16(21)9-5-14/h4-11H,3,12-13H2,1-2H3
InChIKey CRUUBZPNAZWGGM-UHFFFAOYSA-N
Mol Weight 389.84 g/mol
Molecular Formula C20H20ClNO5
Exact Mass 389.103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dBD0Sc0ian
Name 5-(4-Chlorophenyl)-2-methyl-2-(4-nitrophenyl)-5-oxopentanoic acid ethyl ester
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Formula C20H20ClNO5
InChI InChI=1S/C20H20ClNO5/c1-3-27-19(24)20(2,15-6-10-17(11-7-15)22(25)26)13-12-18(23)14-4-8-16(21)9-5-14/h4-11H,3,12-13H2,1-2H3
InChIKey CRUUBZPNAZWGGM-UHFFFAOYSA-N
Molecular Weight 389.835 g/mol
SMILES c1(N(=O)=O)ccc(C(C(=O)OCC)(CCC(c2ccc(cc2)Cl)=O)C)cc1
SPLASH splash10-01p9-0910000000-44511afa721e0d76fafd
Source of Spectrum SK-27-1458-3
Synonyms 5-(4-Chlorophenyl)-5-keto-2-methyl-2-(4-nitrophenyl)valeric acid ethyl ester Ethyl 5-(4-chlorophenyl)-2-methyl-2-(4-nitrophenyl)-5-oxidanylidene-pentanoate Ethyl 5-(4-chlorophenyl)-2-methyl-2-(4-nitrophenyl)-5-oxo-pentanoate
Wiley ID 867743