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Acetic acid, 2,2,2-trifluoro-, 2,6-dichloro-4-[[1-[[(2-chloro-5-nitrophenyl)amino]carbonyl]-3,3-dimethyl-2-oxobutyl](2,2,2-trifluoroacetyl)amino]phenyl ester
SpectraBase Compound ID 5ncFNR9esBe
InChI InChI=1S/C23H16Cl3F6N3O7/c1-21(2,3)17(36)15(18(37)33-14-8-9(35(40)41)4-5-11(14)24)34(19(38)22(27,28)29)10-6-12(25)16(13(26)7-10)42-20(39)23(30,31)32/h4-8,15H,1-3H3,(H,33,37)
InChIKey SMXFXQNZQICDPX-UHFFFAOYSA-N
Mol Weight 666.74 g/mol
Molecular Formula C23H16Cl3F6N3O7
Exact Mass 664.995802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AhUUvSBvM
Name Acetic acid, 2,2,2-trifluoro-, 2,6-dichloro-4-[[1-[[(2-chloro-5-nitrophenyl)amino]carbonyl]-3,3-dimethyl-2-oxobutyl](2,2,2-trifluoroacetyl)amino]phenyl ester
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Formula C23H16Cl3F6N3O7
InChI InChI=1S/C23H16Cl3F6N3O7/c1-21(2,3)17(36)15(18(37)33-14-8-9(35(40)41)4-5-11(14)24)34(19(38)22(27,28)29)10-6-12(25)16(13(26)7-10)42-20(39)23(30,31)32/h4-8,15H,1-3H3,(H,33,37)
InChIKey SMXFXQNZQICDPX-UHFFFAOYSA-N
Molecular Weight 666.744 g/mol
SMILES N(C(C(C(C(C)(C)C)=O)N(C(=O)C(F)(F)F)c1cc(Cl)c(OC(=O)C(F)(F)F)c(Cl)c1)=O)c1cc(ccc1Cl)[N+]([O-])=O
SPLASH splash10-001i-2060293000-f9c80a873aa10bb64a7d
Source of Spectrum JX-2015-4-1412
Synonyms 2,6-Dichloro-4-(N-(1-((2-chloro-5-nitrophenyl)amino)-4,4-dimethyl-1,3-dioxopentan-2-yl)-2,2,2-trifluoroacetamido)phenyl 2,2,2-trifluoroacetate 2,6-Dichloro-4-[{1-[(2-chloro-5-nitrophenyl)amino]-4,4-dimethyl-1,3-dioxopentan-2-yl}(trifluoroacetyl)amino]phenyl trifluoroacetate 2,2,2-trifluoroacetic acid [2,6-dichloro-4-[[1-(2-chloro-5-nitroanilino)-4,4-dimethyl-1,3-dioxopentan-2-yl]-(2,2,2-trifluoro-1-oxoethyl)amino]phenyl] ester [2,6-dichloro-4-[[1-(2-chloro-5-nitroanilino)-4,4-dimethyl-1,3-dioxopentan-2-yl]-(2,2,2-trifluoroacetyl)amino]phenyl] 2,2,2-trifluoroacetate [2,6-dichloro-4-[[1-[(2-chloro-5-nitro-phenyl)carbamoyl]-3,3-dimethyl-2-oxo-butyl]-(2,2,2-trifluoroacetyl)amino]phenyl] 2,2,2-trifluoroacetate [2,6-bis(chloranyl)-4-[[1-[(2-chloranyl-5-nitro-phenyl)amino]-4,4-dimethyl-1,3-bis(oxidanylidene)pentan-2-yl]-[2,2,2-tris(fluoranyl)ethanoyl]amino]phenyl] 2,2,2-tris(fluoranyl)ethanoate
Wiley ID 1726800