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N'-[(5-hydroxy-3-methyl-1-phenylpyrazol-4-yl)methylidene]thiophene-2-carbohydrazide
SpectraBase Compound ID Fi9iuZwcaXU
InChI InChI=1S/C16H14N4O2S/c1-11-13(10-17-18-15(21)14-8-5-9-23-14)16(22)20(19-11)12-6-3-2-4-7-12/h2-10,22H,1H3,(H,18,21)/b17-10+
InChIKey XHDBJLABRPEKQW-LICLKQGHSA-N
Mol Weight 326.37 g/mol
Molecular Formula C16H14N4O2S
Exact Mass 326.083747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7e2mJl6LFvT
Name N'-[(5-hydroxy-3-methyl-1-phenylpyrazol-4-yl)methylidene]thiophene-2-carbohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 326.083746879 u
Formula C16H14N4O2S
InChI InChI=1S/C16H14N4O2S/c1-11-13(10-17-18-15(21)14-8-5-9-23-14)16(22)20(19-11)12-6-3-2-4-7-12/h2-10,22H,1H3,(H,18,21)/b17-10+
InChIKey XHDBJLABRPEKQW-LICLKQGHSA-N
Molecular Weight 326.374 g/mol
SMILES CC1=NN(C2=CC=CC=C2)C(=C1\C=N\NC(C1=CC=CS1)=O)O