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4-(4-chloro-2,5-dimethoxyphenyl)-1-(cyanoacetyl)-3-thiosemicarbazide
SpectraBase Compound ID 5LVOt97VDzk
InChI InChI=1S/C12H13ClN4O3S/c1-19-9-6-8(10(20-2)5-7(9)13)15-12(21)17-16-11(18)3-4-14/h5-6H,3H2,1-2H3,(H,16,18)(H2,15,17,21)
InChIKey LSVZFOAXXIKCMW-UHFFFAOYSA-N
Mol Weight 328.77 g/mol
Molecular Formula C12H13ClN4O3S
Exact Mass 328.039689 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oFwGDvlaaP
Name 4-(4-chloro-2,5-dimethoxyphenyl)-1-(cyanoacetyl)-3-thiosemicarbazide
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Formula C12H13ClN4O3S
InChI InChI=1S/C12H13ClN4O3S/c1-19-9-6-8(10(20-2)5-7(9)13)15-12(21)17-16-11(18)3-4-14/h5-6H,3H2,1-2H3,(H,16,18)(H2,15,17,21)
InChIKey LSVZFOAXXIKCMW-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 24816M
Solvent DMSO-d6