John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=KP0gQMf83fs SpectraBase Spectrum ID=8kbtgCuxH8b

(accessed ).
4,7-DIMETHYL-6-(4-TOLYL)-5,6,7,8-TETRAHYDRO-4H-1,3,2,6-DIOXATHIAZOCEINE-2-OXIDE
SpectraBase Compound ID KP0gQMf83fs
InChI InChI=1S/C13H19NO3S/c1-10-4-6-13(7-5-10)14-8-12(3)17-18(15)16-9-11(14)2/h4-7,11-12H,8-9H2,1-3H3
InChIKey YJFMDKRCONGTAF-UHFFFAOYSA-N
Mol Weight 269.36 g/mol
Molecular Formula C13H19NO3S
Exact Mass 269.108565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kbtgCuxH8b
Name 4,7-DIMETHYL-6-(4-TOLYL)-5,6,7,8-TETRAHYDRO-4H-1,3,2,6-DIOXATHIAZOCEINE-2-OXIDE
Compound Number 4B
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Formula C13H19NO3S
InChI InChI=1S/C13H19NO3S/c1-10-4-6-13(7-5-10)14-8-12(3)17-18(15)16-9-11(14)2/h4-7,11-12H,8-9H2,1-3H3
InChIKey YJFMDKRCONGTAF-UHFFFAOYSA-N
Literature Reference Author T.NISHIYAMA,H.YAMAGUCHI,F.YAMADA
Literature Reference Citation J.HETCYCL.CHEM.,27,143(1990)
Literature Reference DOI 10.1002/jhet.5570270205
Molecular Weight 269.359 g/mol
Solvent CDCl3
Source File Reference UWCP4869
SpectraBase Batch ID HZaqQpxK0cc