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N-(2,4-Dimethylphenyl)-2-(4-nitrobenzoyl)hydrazinecarbothioamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(2,4-Dimethylphenyl)-2-(4-nitrobenzoyl)hydrazinecarbothioamide
SpectraBase Compound ID 1igEBOYlz8B
InChI InChI=1S/C16H16N4O3S/c1-10-3-8-14(11(2)9-10)17-16(24)19-18-15(21)12-4-6-13(7-5-12)20(22)23/h3-9H,1-2H3,(H,18,21)(H2,17,19,24)
InChIKey LHJPZPKREHNLCG-UHFFFAOYSA-N
Mol Weight 344.39 g/mol
Molecular Formula C16H16N4O3S
Exact Mass 344.094312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID w9ve4uWgDd
Name N-(2,4-Dimethylphenyl)-2-(4-nitrobenzoyl)hydrazinecarbothioamide
Comments Computed using HOSE algorithm
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Exact Mass 344.094311562 u
Formula C16H16N4O3S
InChI InChI=1S/C16H16N4O3S/c1-10-3-8-14(11(2)9-10)17-16(24)19-18-15(21)12-4-6-13(7-5-12)20(22)23/h3-9H,1-2H3,(H,18,21)(H2,17,19,24)
InChIKey LHJPZPKREHNLCG-UHFFFAOYSA-N
Molecular Weight 344.389 g/mol
SMILES C=1(N(=O)=O)C=CC(C(NNC(NC=2C(=CC(=CC2)C)C)=S)=O)=CC1