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ETHYL-ALPHA-(2-QUINOLYLTHIO)-ACETATE

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ETHYL-ALPHA-(2-QUINOLYLTHIO)-ACETATE
SpectraBase Compound ID FsnSQJQz7s
InChI InChI=1S/C13H13NO2S/c1-2-16-13(15)9-17-12-8-7-10-5-3-4-6-11(10)14-12/h3-8H,2,9H2,1H3
InChIKey AIHOCXBKNMJTLF-UHFFFAOYSA-N
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GqUY8KPYZrz
Name ETHYL-ALPHA-(2-QUINOLYLTHIO)-ACETATE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-2-16-13(15)9-17-12-8-7-10-5-3-4-6-11(10)14-12/h3-8H,2,9H2,1H3
InChIKey AIHOCXBKNMJTLF-UHFFFAOYSA-N
Literature Reference Author K.M.DAWOOD,T.FUCHIGAMI
Literature Reference Citation J.ORG.CHEM.,64,138(1999)
Literature Reference DOI 10.1021/jo981476s
Molecular Weight 247.312 g/mol
Sample ID 39187
Solvent CDCl3