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(4-ISOPROPYL-3-METHYL-1-PHENYL-1H-PYRAZOL-5-YL)-4-METHOXYBENZOATE
SpectraBase Compound ID ECOso3E5zP0
InChI InChI=1S/C21H22N2O3/c1-14(2)19-15(3)22-23(17-8-6-5-7-9-17)20(19)26-21(24)16-10-12-18(25-4)13-11-16/h5-14H,1-4H3
InChIKey CUZWBVNXFMQSLU-UHFFFAOYSA-N
Mol Weight 350.42 g/mol
Molecular Formula C21H22N2O3
Exact Mass 350.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AaIPGhYIQ7A
Name (4-ISOPROPYL-3-METHYL-1-PHENYL-1H-PYRAZOL-5-YL)-4-METHOXYBENZOATE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N2O3
InChI InChI=1S/C21H22N2O3/c1-14(2)19-15(3)22-23(17-8-6-5-7-9-17)20(19)26-21(24)16-10-12-18(25-4)13-11-16/h5-14H,1-4H3
InChIKey CUZWBVNXFMQSLU-UHFFFAOYSA-N
Literature Reference Author H.MARUOKA,K.YAMAGATA,F.OKABE,Y.TOMIOKA
Literature Reference Citation J.HETCYCL.CHEM.,43,859(2006)
Literature Reference DOI 10.1002/jhet.5570430408
Molecular Weight 350.417 g/mol
Sample ID 67529
Solvent CDCl3