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Pentanamide, 2-[[4-(acetyloxy)-3,5-dichlorophenyl]amino]-4,4-dimethyl-N-(5-nitro-2-propoxyphenyl)-3-oxo-
SpectraBase Compound ID 5ScwpEcTNPc
InChI InChI=1S/C24H27Cl2N3O7/c1-6-9-35-19-8-7-15(29(33)34)12-18(19)28-23(32)20(22(31)24(3,4)5)27-14-10-16(25)21(17(26)11-14)36-13(2)30/h7-8,10-12,20,27H,6,9H2,1-5H3,(H,28,32)
InChIKey LOKXQFJTNIXELF-UHFFFAOYSA-N
Mol Weight 540.4 g/mol
Molecular Formula C24H27Cl2N3O7
Exact Mass 539.122606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LYI97gg57w
Name Pentanamide, 2-[[4-(acetyloxy)-3,5-dichlorophenyl]amino]-4,4-dimethyl-N-(5-nitro-2-propoxyphenyl)-3-oxo-
Alternate Name(s) 2,6-Dichloro-4-((4,4-dimethyl-1-((5-nitro-2-propoxyphenyl)amino)-1,3-dioxopentan-2-yl)amino)phenyl acetate 2,6-Dichloro-4-({4,4-dimethyl-1-[(5-nitro-2-propoxyphenyl)amino]-1,3-dioxopentan-2-yl}amino)phenyl acetate Acetic acid [2,6-dichloro-4-[[4,4-dimethyl-1-(5-nitro-2-propoxyanilino)-1,3-dioxopentan-2-yl]amino]phenyl] ester [2,6-dichloro-4-[[4,4-dimethyl-1-(5-nitro-2-propoxyanilino)-1,3-dioxopentan-2-yl]amino]phenyl] acetate [2,6-dichloro-4-[[3,3-dimethyl-1-[(5-nitro-2-propoxy-phenyl)carbamoyl]-2-oxo-butyl]amino]phenyl] acetate [2,6-bis(chloranyl)-4-[[4,4-dimethyl-1-[(5-nitro-2-propoxy-phenyl)amino]-1,3-bis(oxidanylidene)pentan-2-yl]amino]phenyl] ethanoate
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Formula C24H27Cl2N3O7
InChI InChI=1S/C24H27Cl2N3O7/c1-6-9-35-19-8-7-15(29(33)34)12-18(19)28-23(32)20(22(31)24(3,4)5)27-14-10-16(25)21(17(26)11-14)36-13(2)30/h7-8,10-12,20,27H,6,9H2,1-5H3,(H,28,32)
InChIKey LOKXQFJTNIXELF-UHFFFAOYSA-N
Molecular Weight 540.400 g/mol
SMILES N(c1cc([N+]([O-])=O)ccc1OCCC)C(C(Nc1cc(Cl)c(OC(=O)C)c(Cl)c1)C(=O)C(C)(C)C)=O
SPLASH splash10-06r6-7921700000-3aaf94f19a6bd43ce11c
Source of Spectrum JX-2015-4-1122
Wiley ID 1726519