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N-BOC-5-methyl-3-phenyl-3-chlorooxindole
SpectraBase Compound ID I3BAQAOwjM9
InChI InChI=1S/C20H20ClNO3/c1-13-10-11-16-15(12-13)20(21,14-8-6-5-7-9-14)17(23)22(16)18(24)25-19(2,3)4/h5-12H,1-4H3
InChIKey KCKHWTNLCAOIAE-UHFFFAOYSA-N
Mol Weight 357.84 g/mol
Molecular Formula C20H20ClNO3
Exact Mass 357.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jUMqjrNGue
Name N-BOC-5-methyl-3-phenyl-3-chlorooxindole
Alternate Name(s) 3-Chloro-5-methyl-2-oxo-3-phenyl-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-chloro-5-methyl-2-oxo-3-phenylindole-1-carboxylate tert-Butyl 3-chloro-5-methyl-2-oxo-3-phenyl-indoline-1-carboxylate tert-Butyl 3-chloranyl-5-methyl-2-oxidanylidene-3-phenyl-indole-1-carboxylate
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Formula C20H20ClNO3
InChI InChI=1S/C20H20ClNO3/c1-13-10-11-16-15(12-13)20(21,14-8-6-5-7-9-14)17(23)22(16)18(24)25-19(2,3)4/h5-12H,1-4H3
InChIKey KCKHWTNLCAOIAE-UHFFFAOYSA-N
Molecular Weight 357.837 g/mol
SMILES C1(N(c2c(C1(c1ccccc1)Cl)cc(cc2)C)C(OC(C)(C)C)=O)=O
SPLASH splash10-05fr-1190000000-7997b4dc6ab7d7dad469
Source of Spectrum U1-2011-3005-3c
Wiley ID 1665592