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[3-(2-Hydroxy-phenyl)-1H-pyrazol-4-yl]-o-tolyl-methanone
SpectraBase Compound ID 97NWJYNtZGQ
InChI InChI=1S/C17H14N2O2/c1-11-6-2-3-7-12(11)17(21)14-10-18-19-16(14)13-8-4-5-9-15(13)20/h2-10,20H,1H3,(H,18,19)
InChIKey JHGZQPKMQNONHI-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C17H14N2O2
Exact Mass 278.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74s5EVu3RaR
Name [3-(2-Hydroxy-phenyl)-1H-pyrazol-4-yl]-o-tolyl-methanone
Comments Computed using HOSE algorithm
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Exact Mass 278.105527697 u
Formula C17H14N2O2
InChI InChI=1S/C17H14N2O2/c1-11-6-2-3-7-12(11)17(21)14-10-18-19-16(14)13-8-4-5-9-15(13)20/h2-10,20H,1H3,(H,18,19)
InChIKey JHGZQPKMQNONHI-UHFFFAOYSA-N
SMILES C=1(C(C2=C(O)C=CC=C2)=NNC1)C(C1=C(C)C=CC=C1)=O