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N-BOC-3-benzyl-3-chlorooxindole
SpectraBase Compound ID GQ3o5Vsx0TV
InChI InChI=1S/C20H20ClNO3/c1-19(2,3)25-18(24)22-16-12-8-7-11-15(16)20(21,17(22)23)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3
InChIKey ATTMBPPAHZIOLD-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 5Wu05Ag15j3
Name N-BOC-3-benzyl-3-chlorooxindole
Alternate Name(s) 3-Chloro-2-oxo-3-(phenylmethyl)-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-benzyl-3-chloro-2-oxoindole-1-carboxylate tert-Butyl 3-benzyl-3-chloro-2-oxo-indoline-1-carboxylate tert-Butyl 3-chloranyl-2-oxidanylidene-3-(phenylmethyl)indole-1-carboxylate
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Formula C20H20ClNO3
InChI InChI=1S/C20H20ClNO3/c1-19(2,3)25-18(24)22-16-12-8-7-11-15(16)20(21,17(22)23)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3
InChIKey ATTMBPPAHZIOLD-UHFFFAOYSA-N
Molecular Weight 357.837 g/mol
SMILES C1(N(c2c(C1(Cc1ccccc1)Cl)cccc2)C(OC(C)(C)C)=O)=O
SPLASH splash10-0a4l-9080000000-41220f5407e6aad4f32c
Source of Spectrum U1-2011-3005-3o
Wiley ID 1665580