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Ethyl 5-(3-chlorophenyl)-4-methyl-1-phenyl-1H-pyrazole-3-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl 5-(3-chlorophenyl)-4-methyl-1-phenyl-1H-pyrazole-3-carboxylate
SpectraBase Compound ID AX37tfpaaeK
InChI InChI=1S/C19H17ClN2O2/c1-3-24-19(23)17-13(2)18(14-8-7-9-15(20)12-14)22(21-17)16-10-5-4-6-11-16/h4-12H,3H2,1-2H3
InChIKey GCNQAXSNUYIWRO-UHFFFAOYSA-N
Mol Weight 340.81 g/mol
Molecular Formula C19H17ClN2O2
Exact Mass 340.097855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Prv6SYMNVz
Name Ethyl 5-(3-chlorophenyl)-4-methyl-1-phenyl-1H-pyrazole-3-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 340.097855493 u
Formula C19H17ClN2O2
InChI InChI=1S/C19H17ClN2O2/c1-3-24-19(23)17-13(2)18(14-8-7-9-15(20)12-14)22(21-17)16-10-5-4-6-11-16/h4-12H,3H2,1-2H3
InChIKey GCNQAXSNUYIWRO-UHFFFAOYSA-N
Molecular Weight 340.810 g/mol
SMILES C1(=NN(C(=C1C)C1=CC(Cl)=CC=C1)C1=CC=CC=C1)C(=O)OCC