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Benzeneacetic acid, 4-[[1-[(2-ethoxybenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]-.alpha.-hydroxy-3-methoxy-.alpha.-(trifluoromethyl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

Benzeneacetic acid, 4-[[1-[(2-ethoxybenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]-.alpha.-hydroxy-3-methoxy-.alpha.-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID HEmtHdbyf0D
InChI InChI=1S/C23H21F9N2O6/c1-4-40-15-8-6-5-7-13(15)17(35)34-20(22(27,28)29,23(30,31)32)33-14-10-9-12(11-16(14)38-2)19(37,18(36)39-3)21(24,25)26/h5-11,33,37H,4H2,1-3H3,(H,34,35)
InChIKey ZSGOLOIZXSIOTC-UHFFFAOYSA-N
Mol Weight 592.41 g/mol
Molecular Formula C23H21F9N2O6
Exact Mass 592.12559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tKPvGDjnuP
Name Benzeneacetic acid, 4-[[1-[(2-ethoxybenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]-.alpha.-hydroxy-3-methoxy-.alpha.-(trifluoromethyl)-, methyl ester
Alternate Name(s) Methyl 2-[4-({2-[(2-ethoxyphenyl)formamido]-1,1,1,3,3,3-hexafluoropropan-2-yl}amino)-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate 2-[4-[[2-[[(2-ethoxyphenyl)-oxomethyl]amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]amino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester Methyl 2-[4-[[2-[(2-ethoxybenzoyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]amino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate Methyl 2-[4-[[1-[(2-ethoxybenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]-3-methoxy-phenyl]-3,3,3-trifluoro-2-hydroxy-propanoate Methyl 2-[4-[[2-[(2-ethoxyphenyl)carbonylamino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]amino]-3-methoxy-phenyl]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate
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Formula C23H21F9N2O6
InChI InChI=1S/C23H21F9N2O6/c1-4-40-15-8-6-5-7-13(15)17(35)34-20(22(27,28)29,23(30,31)32)33-14-10-9-12(11-16(14)38-2)19(37,18(36)39-3)21(24,25)26/h5-11,33,37H,4H2,1-3H3,(H,34,35)
InChIKey ZSGOLOIZXSIOTC-UHFFFAOYSA-N
Molecular Weight 592.415 g/mol
SMILES OC(c1ccc(c(c1)OC)NC(NC(=O)c1ccccc1OCC)(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(OC)=O
SPLASH splash10-016s-0689510000-1f4349a34267b8939545
Source of Spectrum IY-2-5041-3
Wiley ID 1658396