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1-(p-chlorophenyl)-1H-tetrazole-5-acetaldehyde, (2,4-dinitrophenyl)hydrazone
SpectraBase Compound ID If2Tk4dulzM
InChI InChI=1S/C15H11ClN8O4/c16-10-1-3-11(4-2-10)22-15(19-20-21-22)7-8-17-18-13-6-5-12(23(25)26)9-14(13)24(27)28/h1-6,8-9,18H,7H2/b17-8+
InChIKey ZQIRNQJXYWIAEH-CAOOACKPSA-N
Mol Weight 402.76 g/mol
Molecular Formula C15H11ClN8O4
Exact Mass 402.059179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5XuMlNnVA2r
Name 1-(p-Chlorophenyl)-1H-tetrazole-5-acetaldehyde, (2,4-dinitrophenyl)hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 402.059178562 u
Formula C15H11ClN8O4
InChI InChI=1S/C15H11ClN8O4/c16-10-1-3-11(4-2-10)22-15(19-20-21-22)7-8-17-18-13-6-5-12(23(25)26)9-14(13)24(27)28/h1-6,8-9,18H,7H2/b17-8+
InChIKey ZQIRNQJXYWIAEH-CAOOACKPSA-N
Molecular Weight 402.758 g/mol
SMILES N(\N=C\CC=1N(N=NN1)C=1C=CC(=CC1)Cl)C=1C(=CC(=CC1)N(=O)=O)N(=O)=O