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1H-pyrazole-3-carboxylic acid, 1-(2-methoxyphenyl)-5-phenyl-, ethyl ester

View entire compound with spectra: 2 NMR

1H-pyrazole-3-carboxylic acid, 1-(2-methoxyphenyl)-5-phenyl-, ethyl ester
SpectraBase Compound ID 7EUhdDxYC2d
InChI InChI=1S/C19H18N2O3/c1-3-24-19(22)15-13-17(14-9-5-4-6-10-14)21(20-15)16-11-7-8-12-18(16)23-2/h4-13H,3H2,1-2H3
InChIKey RTOFSNIYLHABMY-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C19H18N2O3
Exact Mass 322.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PWfxow1nqe
Name 1H-Pyrazole-3-carboxylic acid, 1-(2-methoxyphenyl)-5-phenyl-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 322.131742445 u
Formula C19H18N2O3
InChI InChI=1S/C19H18N2O3/c1-3-24-19(22)15-13-17(14-9-5-4-6-10-14)21(20-15)16-11-7-8-12-18(16)23-2/h4-13H,3H2,1-2H3
InChIKey RTOFSNIYLHABMY-UHFFFAOYSA-N
Molecular Weight 322.364 g/mol
SMILES C1=CC=C(C=2N(N=C(C(=O)OCC)C2)C2=C(OC)C=CC=C2)C=C1