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3-(1'-CHLOROMETHYL-2',2'-DIMETHYLPROPYLTHIO)-THIOCHROMONE-1,1-DIOXIDE
SpectraBase Compound ID 3SAQedyzghv
InChI InChI=1S/C15H17ClO3S2/c1-15(2,3)13(8-16)20-11-9-21(18,19)12-7-5-4-6-10(12)14(11)17/h4-7,9,13H,8H2,1-3H3/t13-/m1/s1
InChIKey VKCNVNBWRLJROW-CYBMUJFWSA-N
Mol Weight 344.87 g/mol
Molecular Formula C15H17ClO3S2
Exact Mass 344.030764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9cvAWITI7du
Name 3-(1'-CHLOROMETHYL-2',2'-DIMETHYLPROPYLTHIO)-THIOCHROMONE-1,1-DIOXIDE
Compound Number 8G
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Formula C15H17ClO3S2
InChI InChI=1S/C15H17ClO3S2/c1-15(2,3)13(8-16)20-11-9-21(18,19)12-7-5-4-6-10(12)14(11)17/h4-7,9,13H,8H2,1-3H3/t13-/m1/s1
InChIKey VKCNVNBWRLJROW-CYBMUJFWSA-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 344.871 g/mol
Solvent CDCl3
Source File Reference UWVP4989