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2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-1-naphthylmethylidene]acetohydrazide
SpectraBase Compound ID 7PWhEgNKtNN
InChI InChI=1S/C18H17BrN4O/c1-12-18(19)13(2)23(22-12)11-17(24)21-20-10-15-8-5-7-14-6-3-4-9-16(14)15/h3-10H,11H2,1-2H3,(H,21,24)/b20-10+
InChIKey KGBOLSVDIYKIOY-KEBDBYFISA-N
Mol Weight 385.27 g/mol
Molecular Formula C18H17BrN4O
Exact Mass 384.058574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KO91s4EAfXf
Name 2-(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N'-[(E)-1-naphthylmethylidene]acetohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 384.058574182 u
Formula C18H17BrN4O
InChI InChI=1S/C18H17BrN4O/c1-12-18(19)13(2)23(22-12)11-17(24)21-20-10-15-8-5-7-14-6-3-4-9-16(14)15/h3-10H,11H2,1-2H3,(H,21,24)/b20-10+
InChIKey KGBOLSVDIYKIOY-KEBDBYFISA-N
Molecular Weight 385.265 g/mol
SMILES N(\N=C\C1=C2C(C=CC=C2)=CC=C1)C(CN1N=C(C)C(=C1C)Br)=O