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4-[4-Chlorophenyl]-3-thiosemicarbazone p-dimethylaminobenzaldehyde

View entire compound with spectra: 1 NMR, and 1 FTIR

4-[4-Chlorophenyl]-3-thiosemicarbazone p-dimethylaminobenzaldehyde
SpectraBase Compound ID KvvW2mzGKWl
InChI InChI=1S/C16H17ClN4S/c1-21(2)15-9-3-12(4-10-15)11-18-20-16(22)19-14-7-5-13(17)6-8-14/h3-11H,1-2H3,(H2,19,20,22)/b18-11+
InChIKey DMOLVAACDFVLLL-WOJGMQOQSA-N
Mol Weight 332.85 g/mol
Molecular Formula C16H17ClN4S
Exact Mass 332.086245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HozKBZPRsBE
Name 4-[4-Chlorophenyl]-3-thiosemicarbazone p-dimethylaminobenzaldehyde
Comments Computed using HOSE algorithm
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Exact Mass 332.086245437 u
Formula C16H17ClN4S
InChI InChI=1S/C16H17ClN4S/c1-21(2)15-9-3-12(4-10-15)11-18-20-16(22)19-14-7-5-13(17)6-8-14/h3-11H,1-2H3,(H2,19,20,22)/b18-11+
InChIKey DMOLVAACDFVLLL-WOJGMQOQSA-N
Molecular Weight 332.853 g/mol
SMILES C1=C(C=CC(=C1)Cl)NC(N\N=C\C1=CC=C(C=C1)N(C)C)=S