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1-(4-tert-butyl-3,5-dinitro-α,2,6-trimethylbenzylidene)-4-(2,6-diethylphenyl)-3-thiosemicarbazide

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1-(4-tert-butyl-3,5-dinitro-α,2,6-trimethylbenzylidene)-4-(2,6-diethylphenyl)-3-thiosemicarbazide
SpectraBase Compound ID A7gkM2QCXvv
InChI InChI=1S/C25H33N5O4S/c1-9-17-12-11-13-18(10-2)21(17)26-24(35)28-27-16(5)19-14(3)22(29(31)32)20(25(6,7)8)23(15(19)4)30(33)34/h11-13H,9-10H2,1-8H3,(H2,26,28,35)/b27-16+
InChIKey OQNOBDAWEMDSCB-JVWAILMASA-N
Mol Weight 499.6 g/mol
Molecular Formula C25H33N5O4S
Exact Mass 499.225326 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40HBv2VQZKm
Name 1-(4-tert-butyl-3,5-dinitro-α,2,6-trimethylbenzylidene)-4-(2,6-diethylphenyl)-3-thiosemicarbazide
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Formula C25H33N5O4S
InChI InChI=1S/C25H33N5O4S/c1-9-17-12-11-13-18(10-2)21(17)26-24(35)28-27-16(5)19-14(3)22(29(31)32)20(25(6,7)8)23(15(19)4)30(33)34/h11-13H,9-10H2,1-8H3,(H2,26,28,35)/b27-16+
InChIKey OQNOBDAWEMDSCB-JVWAILMASA-N
Instrument Name Varian A-60D
Sadtler NMR Number 19719M
Solvent Polysol