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2-{2-[(2,6-DINITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLYL)OXY]-5-NITROPHENYL}-1,3-DITHIOLANE
SpectraBase Compound ID DcxhdQQZnP2
InChI InChI=1S/C16H10F3N3O7S2/c17-16(18,19)8-5-11(21(25)26)14(12(6-8)22(27)28)29-13-2-1-9(20(23)24)7-10(13)15-30-3-4-31-15/h1-2,5-7,15H,3-4H2
InChIKey WMDCPCAFUYDYGA-UHFFFAOYSA-N
Mol Weight 477.39 g/mol
Molecular Formula C16H10F3N3O7S2
Exact Mass 476.991227 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HPewcE3pGsL
Name 2-{2-[(2,6-dinitro-alpha,alpha,alpha-trifluoro-p-tolyl)oxy]-5-nitrophenyl}-1,3-dithiolane
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Formula C16H10F3N3O7S2
InChI InChI=1S/C16H10F3N3O7S2/c17-16(18,19)8-5-11(21(25)26)14(12(6-8)22(27)28)29-13-2-1-9(20(23)24)7-10(13)15-30-3-4-31-15/h1-2,5-7,15H,3-4H2
InChIKey WMDCPCAFUYDYGA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 56276M
Solvent Polysol