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methyl 4-benzoyl-3-(4-morpholinylcarbonyl)-1H-pyrazole-5-carboxylate

View entire compound with spectra: 2 NMR

methyl 4-benzoyl-3-(4-morpholinylcarbonyl)-1H-pyrazole-5-carboxylate
SpectraBase Compound ID 3YjE94q0kgW
InChI InChI=1S/C17H17N3O5/c1-24-17(23)14-12(15(21)11-5-3-2-4-6-11)13(18-19-14)16(22)20-7-9-25-10-8-20/h2-6H,7-10H2,1H3,(H,18,19)
InChIKey OUKSHBUEOIIJGO-UHFFFAOYSA-N
Mol Weight 343.34 g/mol
Molecular Formula C17H17N3O5
Exact Mass 343.116821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EXmJrKK4mcR
Name Methyl 4-benzoyl-3-(4-morpholinylcarbonyl)-1H-pyrazole-5-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 343.116820654 u
Formula C17H17N3O5
InChI InChI=1S/C17H17N3O5/c1-24-17(23)14-12(15(21)11-5-3-2-4-6-11)13(18-19-14)16(22)20-7-9-25-10-8-20/h2-6H,7-10H2,1H3,(H,18,19)
InChIKey OUKSHBUEOIIJGO-UHFFFAOYSA-N
Molecular Weight 343.339 g/mol
SMILES N1N=C(C(=C1C(=O)OC)C(=O)C=1C=CC=CC1)C(N1CCOCC1)=O