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N-BOC-5-fluoro-3-(p-methylphenyl)-3-chlorooxindole
SpectraBase Compound ID FX9zYVAzFO3
InChI InChI=1S/C20H19ClFNO3/c1-12-5-7-13(8-6-12)20(21)15-11-14(22)9-10-16(15)23(17(20)24)18(25)26-19(2,3)4/h5-11H,1-4H3
InChIKey NVPIRSJEHAWRBN-UHFFFAOYSA-N
Mol Weight 375.83 g/mol
Molecular Formula C20H19ClFNO3
Exact Mass 375.103749 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AhMl9TwSUe
Name N-BOC-5-fluoro-3-(p-methylphenyl)-3-chlorooxindole
Alternate Name(s) 3-Chloro-5-fluoro-3-(4-methylphenyl)-2-oxo-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-chloro-5-fluoro-3-(4-methylphenyl)-2-oxoindole-1-carboxylate tert-Butyl 3-chloro-5-fluoro-2-oxo-3-(p-tolyl)indoline-1-carboxylate tert-Butyl 3-chloranyl-5-fluoranyl-3-(4-methylphenyl)-2-oxidanylidene-indole-1-carboxylate
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Formula C20H19ClFNO3
InChI InChI=1S/C20H19ClFNO3/c1-12-5-7-13(8-6-12)20(21)15-11-14(22)9-10-16(15)23(17(20)24)18(25)26-19(2,3)4/h5-11H,1-4H3
InChIKey NVPIRSJEHAWRBN-UHFFFAOYSA-N
Molecular Weight 375.827 g/mol
SMILES C1(N(c2c(C1(c1ccc(cc1)C)Cl)cc(cc2)F)C(OC(C)(C)C)=O)=O
SPLASH splash10-0006-1090000000-565b701db66e52a36d24
Source of Spectrum U1-2011-3005-3h
Wiley ID 1665587