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4-[(benzylthio)amino]benzoic acid tert-butyl ester
SpectraBase Compound ID GRJlJN5Kz3i
InChI InChI=1S/C18H21NO2S/c1-18(2,3)21-17(20)15-9-11-16(12-10-15)19-22-13-14-7-5-4-6-8-14/h4-12,19H,13H2,1-3H3
InChIKey XKZWLBQOVOAYNU-UHFFFAOYSA-N
Mol Weight 315.43 g/mol
Molecular Formula C18H21NO2S
Exact Mass 315.1293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A3ot4IJ9kdM
Name 4-[(benzylthio)amino]benzoic acid tert-butyl ester
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21NO2S
InChI InChI=1S/C18H21NO2S/c1-18(2,3)21-17(20)15-9-11-16(12-10-15)19-22-13-14-7-5-4-6-8-14/h4-12,19H,13H2,1-3H3
InChIKey XKZWLBQOVOAYNU-UHFFFAOYSA-N
Literature Reference Author W.FRANEK,P.K.CLAUS
Literature Reference Citation MH.CHEM.,121,385(1990)
Literature Reference DOI 10.1007/BF00809455
Molecular Weight 315.430 g/mol
Solvent CDCl3
Source File Reference UWED14693