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p-Toluenesulfonic acid, (alpha-methyl-p-nitrobenzylidene]hydrazide
SpectraBase Compound ID 8fbXH9vtIWa
InChI InChI=1S/C15H15N3O4S/c1-11-3-9-15(10-4-11)23(21,22)17-16-12(2)13-5-7-14(8-6-13)18(19)20/h3-10,17H,1-2H3/b16-12+
InChIKey MSIJYMGYDIADFV-FOWTUZBSSA-N
Mol Weight 333.36 g/mol
Molecular Formula C15H15N3O4S
Exact Mass 333.078327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77C136O4kUc
Name p-Toluenesulfonic acid, (alpha-methyl-p-nitrobenzylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 333.078327145 u
Formula C15H15N3O4S
InChI InChI=1S/C15H15N3O4S/c1-11-3-9-15(10-4-11)23(21,22)17-16-12(2)13-5-7-14(8-6-13)18(19)20/h3-10,17H,1-2H3/b16-12+
InChIKey MSIJYMGYDIADFV-FOWTUZBSSA-N
Molecular Weight 333.362 g/mol
SMILES N(S(C=1C=CC(=CC1)C)(=O)=O)\N=C\(C1=CC=C(C=C1)N(=O)=O)C