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Ethyl 5-(benzoyloxy)-1-phenyl-1H-pyrazole-3-carboxylate

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

Ethyl 5-(benzoyloxy)-1-phenyl-1H-pyrazole-3-carboxylate
SpectraBase Compound ID 2mLe520wIwJ
InChI InChI=1S/C19H16N2O4/c1-2-24-19(23)16-13-17(21(20-16)15-11-7-4-8-12-15)25-18(22)14-9-5-3-6-10-14/h3-13H,2H2,1H3
InChIKey IAJOGIUVBHPQQF-UHFFFAOYSA-N
Mol Weight 336.35 g/mol
Molecular Formula C19H16N2O4
Exact Mass 336.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DCZZRtMiiDm
Name Ethyl 5-(benzoyloxy)-1-phenyl-1H-pyrazole-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.111006999 u
Formula C19H16N2O4
InChI InChI=1S/C19H16N2O4/c1-2-24-19(23)16-13-17(21(20-16)15-11-7-4-8-12-15)25-18(22)14-9-5-3-6-10-14/h3-13H,2H2,1H3
InChIKey IAJOGIUVBHPQQF-UHFFFAOYSA-N
Molecular Weight 336.347 g/mol
SMILES C=1(N(N=C(C1)C(=O)OCC)C=1C=CC=CC1)OC(=O)C1=CC=CC=C1