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3-{[(2,5-dimethoxy-4-nitrophenyl)thio]methyl}-4-p-tolyl-delta square-1,2,4-triazoline-5-thione
SpectraBase Compound ID FPYZv45mROR
InChI InChI=1S/C18H18N4O4S2/c1-11-4-6-12(7-5-11)21-17(19-20-18(21)27)10-28-16-9-14(25-2)13(22(23)24)8-15(16)26-3/h4-9H,10H2,1-3H3,(H,20,27)
InChIKey JQXLOMONZIVCEW-UHFFFAOYSA-N
Mol Weight 418.49 g/mol
Molecular Formula C18H18N4O4S2
Exact Mass 418.076947 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADz4yJ46mNl
Name 3-{[(2,5-dimethoxy-4-nitrophenyl)thio]methyl}-4-p-tolyl-delta square-1,2,4-triazoline-5-thione
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Formula C18H18N4O4S2
InChI InChI=1S/C18H18N4O4S2/c1-11-4-6-12(7-5-11)21-17(19-20-18(21)27)10-28-16-9-14(25-2)13(22(23)24)8-15(16)26-3/h4-9H,10H2,1-3H3,(H,20,27)
InChIKey JQXLOMONZIVCEW-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 29169M
Solvent Polysol