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8,10-DIOXO-9-PHENYL-4-THIA-9-AZATRICYCLO-[5.3.0.0-(2.6)]-DECANE_4,4-DIOXIDE
SpectraBase Compound ID DkZTXxwZok4
InChI InChI=1S/C14H13NO4S/c16-13-11-9-6-20(18,19)7-10(9)12(11)14(17)15(13)8-4-2-1-3-5-8/h1-5,9-12H,6-7H2
InChIKey BGZUKXQOMCFFBF-UHFFFAOYSA-N
Mol Weight 291.32 g/mol
Molecular Formula C14H13NO4S
Exact Mass 291.056529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InAISvUPFVU
Name 8,10-DIOXO-9-PHENYL-4-THIA-9-AZATRICYCLO-[5.3.0.0-(2.6)]-DECANE_4,4-DIOXIDE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13NO4S
InChI InChI=1S/C14H13NO4S/c16-13-11-9-6-20(18,19)7-10(9)12(11)14(17)15(13)8-4-2-1-3-5-8/h1-5,9-12H,6-7H2
InChIKey BGZUKXQOMCFFBF-UHFFFAOYSA-N
Literature Reference Author R.A.AITKEN,J.I.G.CADOGAN,I.GOSNEY,C.M.HUMPHRIES,L.M.MCLAUGHL IN,S.J.WYSE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,605(1999)
Literature Reference DOI 10.1039/a809326a
Molecular Weight 291.322 g/mol
Solvent DMSO-D6
Source File Reference UWMZ11407