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METHYL-5-BENZOYL-4-BENZYL-1H-PYRAZOLE-3-CARBOXYLATE
SpectraBase Compound ID DZUsjCVjT1K
InChI InChI=1S/C19H16N2O3/c1-24-19(23)17-15(12-13-8-4-2-5-9-13)16(20-21-17)18(22)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,20,21)
InChIKey IDQIFLXGQSGHRQ-UHFFFAOYSA-N
Mol Weight 320.35 g/mol
Molecular Formula C19H16N2O3
Exact Mass 320.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AhBk2etnWlt
Name METHYL-5-BENZOYL-4-BENZYL-1H-PYRAZOLE-3-CARBOXYLATE
Compound Number 22A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H16N2O3
InChI InChI=1S/C19H16N2O3/c1-24-19(23)17-15(12-13-8-4-2-5-9-13)16(20-21-17)18(22)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,20,21)
InChIKey IDQIFLXGQSGHRQ-UHFFFAOYSA-N
Literature Reference Author J.WARKENTIN,J.M.R.WOOLLARD
Literature Reference Citation CAN.J.CHEM.,75,289(1997)
Literature Reference DOI 10.1139/v97-033
Molecular Weight 320.348 g/mol
Solvent CDCl3
Source File Reference UWCP5794