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(S)-Ethyl 2-(3-((tert-butoxycarbonyl)amino)-1-ethyl-2-oxoindolin-3-yl)acetate
SpectraBase Compound ID 846UF7Y1u89
InChI InChI=1S/C19H26N2O5/c1-6-21-14-11-9-8-10-13(14)19(16(21)23,12-15(22)25-7-2)20-17(24)26-18(3,4)5/h8-11H,6-7,12H2,1-5H3,(H,20,24)/t19-/m0/s1
InChIKey CNLBBZHWVLPBEN-IBGZPJMESA-N
Mol Weight 362.43 g/mol
Molecular Formula C19H26N2O5
Exact Mass 362.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79C5ycwJLx8
Name (S)-Ethyl 2-(3-((tert-butoxycarbonyl)amino)-1-ethyl-2-oxoindolin-3-yl)acetate
Appearance Colorless solid
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Exact Mass 362.184171940 u
Formula C19H26N2O5
InChI InChI=1S/C19H26N2O5/c1-6-21-14-11-9-8-10-13(14)19(16(21)23,12-15(22)25-7-2)20-17(24)26-18(3,4)5/h8-11H,6-7,12H2,1-5H3,(H,20,24)/t19-/m0/s1
InChIKey CNLBBZHWVLPBEN-IBGZPJMESA-N
Instrument Name Finnigan SSQ7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201406422
Molecular Weight 362.426 g/mol
Optical Rotation [a]D25 = -56.0 (c = 1.0, CHCl3)
Quality 3
Reported Formula C19H26O5N2
SMILES N([C@]1(C=2C=CC=CC2N(C1=O)CC)CC(OCC)=O)C(OC(C)(C)C)=O
SPLASH splash10-03fr-0309000000-c49f27504f83b99da4b8
Sample Comments 96% ee
Source of Spectrum QE-21-SM4-7b (DOI: 10.1002/chem.201406422)
Wiley ID 1906335