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4-Nitrobenzaldehyde-4-phenylthiosemicarbazone
SpectraBase Compound ID 9fbnG85POiO
InChI InChI=1S/C14H12N4O2S/c19-18(20)13-8-6-11(7-9-13)10-15-17-14(21)16-12-4-2-1-3-5-12/h1-10H,(H2,16,17,21)/b15-10+
InChIKey OFVNKRMADPFPSJ-XNTDXEJSSA-N
Mol Weight 300.34 g/mol
Molecular Formula C14H12N4O2S
Exact Mass 300.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xqa7vVi2S
Name 4-Nitrobenzaldehyde-4-phenylthiosemicarbazone
Alternate Name(s) 4-Nitrobenzaldehyde-4-phenylthiosemicarbazone. (E)-2-(4-nitrobenzylidene)-N-phenylhydrazinecarbothioamide 1-[(E)-(4-nitrophenyl)methylideneamino]-3-phenylthiourea 1-[(E)-(4-nitrophenyl)methyleneamino]-3-phenyl-thiourea 1-[(E)-(4-nitrophenyl)methylideneamino]-3-phenyl-thiourea
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Formula C14H12N4O2S
InChI InChI=1S/C14H12N4O2S/c19-18(20)13-8-6-11(7-9-13)10-15-17-14(21)16-12-4-2-1-3-5-12/h1-10H,(H2,16,17,21)/b15-10+
InChIKey OFVNKRMADPFPSJ-XNTDXEJSSA-N
Molecular Weight 300.336 g/mol
SMILES N(C(Nc1ccccc1)=S)\N=C\c1ccc(N(=O)=O)cc1
SPLASH splash10-0fbc-9401000000-ab262c176affe4fa3906
Source of Spectrum Y-51-1066-b
Wiley ID 1741444