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3-(2'-CHLORO-2'-METHYLPROPYLTHIO)-THIOCHROMONE-1,1-DIOXIDE
SpectraBase Compound ID EwO17pTADwy
InChI InChI=1S/C13H13ClO3S2/c1-13(2,14)8-18-10-7-19(16,17)11-6-4-3-5-9(11)12(10)15/h3-7H,8H2,1-2H3
InChIKey JSWOHYOJJRCPQX-UHFFFAOYSA-N
Mol Weight 316.82 g/mol
Molecular Formula C13H13ClO3S2
Exact Mass 315.999464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qrP0huqGYt
Name 3-(2'-CHLORO-2'-METHYLPROPYLTHIO)-THIOCHROMONE-1,1-DIOXIDE
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13ClO3S2
InChI InChI=1S/C13H13ClO3S2/c1-13(2,14)8-18-10-7-19(16,17)11-6-4-3-5-9(11)12(10)15/h3-7H,8H2,1-2H3
InChIKey JSWOHYOJJRCPQX-UHFFFAOYSA-N
Literature Reference Author I.W.J.STILL,D.K.T.WILSON
Literature Reference Citation CAN.J.CHEM.,70,964(1992)
Literature Reference DOI 10.1139/v92-129
Molecular Weight 316.817 g/mol
Solvent CDCl3
Source File Reference UWVP4991