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XATVCDDDFKRQTK-UHFFFAOYSA-N

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XATVCDDDFKRQTK-UHFFFAOYSA-N
SpectraBase Compound ID 9BO5Vk6CRsD
InChI InChI=1S/C22H18N2/c1-17-21(18-11-5-2-6-12-18)23-24(20-15-9-4-10-16-20)22(17)19-13-7-3-8-14-19/h2-16H,1H3
InChIKey XATVCDDDFKRQTK-UHFFFAOYSA-N
Mol Weight 310.4 g/mol
Molecular Formula C22H18N2
Exact Mass 310.146999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jx1OxYnF9Pk
Name 4-METHYL-1,3,5-TRIPHENYLPYRAZOLE
Source of Sample J. Elguero and W. Meutermans, Csic, Madrid, Spain P. Cabildo and R.M. Claramunt, Uned, Ciudad Universitaria, Madrid, Spain Magn. Reson. Chem. 30, 455(1992)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N2
InChI InChI=1S/C22H18N2/c1-17-21(18-11-5-2-6-12-18)23-24(20-15-9-4-10-16-20)22(17)19-13-7-3-8-14-19/h2-16H,1H3
InChIKey XATVCDDDFKRQTK-UHFFFAOYSA-N
Molecular Weight 310.40
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-200
Synonyms PYRAZOLE, 4-METHYL-1,3,5-TRIPHENYL-,