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IESUSHAQIOQASF-UHFFFAOYSA-N

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IESUSHAQIOQASF-UHFFFAOYSA-N
SpectraBase Compound ID 80Nt4Mhqtpk
InChI InChI=1S/C13H16ClNO4S/c1-19-13(16)5-7-20(17,18)15-6-4-10-2-3-12(14)8-11(10)9-15/h2-3,8H,4-7,9H2,1H3
InChIKey IESUSHAQIOQASF-UHFFFAOYSA-N
Mol Weight 317.79 g/mol
Molecular Formula C13H16ClNO4S
Exact Mass 317.048857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1rHNaM0lhu
Name IESUSHAQIOQASF-UHFFFAOYSA-N
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16ClNO4S
InChI InChI=1S/C13H16ClNO4S/c1-19-13(16)5-7-20(17,18)15-6-4-10-2-3-12(14)8-11(10)9-15/h2-3,8H,4-7,9H2,1H3
InChIKey IESUSHAQIOQASF-UHFFFAOYSA-N
Literature Reference Author J.L.JILOS,G.P.ROMANELLI,J.C.AUTINO,H.E.GIACCIO,H.DUDDECK,M.W IEBCKE
Literature Reference Citation MAGN.RES.CHEM.,43,1057(2005)
Literature Reference DOI 10.1002/mrc.1657
Molecular Weight 317.787 g/mol
Solvent CDCl3
Source File Reference UWLU36529