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5-[p-(4-METHYL-1-PIPERAZINYL)PHENYL]-alpha,alpha,alpha-TRIFLUOROPYRAZOLE-1-CARBOXY-m-TOLUIDIDE

View entire compound with spectra: 1 NMR, and 1 FTIR

5-[p-(4-METHYL-1-PIPERAZINYL)PHENYL]-alpha,alpha,alpha-TRIFLUOROPYRAZOLE-1-CARBOXY-m-TOLUIDIDE
SpectraBase Compound ID KDv2EVRiOaH
InChI InChI=1S/C22H22F3N5O/c1-28-11-13-29(14-12-28)19-7-5-16(6-8-19)20-9-10-26-30(20)21(31)27-18-4-2-3-17(15-18)22(23,24)25/h2-10,15H,11-14H2,1H3,(H,27,31)
InChIKey YYJYVZGLQYRJOT-UHFFFAOYSA-N
Mol Weight 429.45 g/mol
Molecular Formula C22H22F3N5O
Exact Mass 429.177645 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ip9zUDYdhnK
Name 5-[p-(4-METHYL-1-PIPERAZINYL)PHENYL]-alpha,alpha,alpha-TRIFLUOROPYRAZOLE-1-CARBOXY-m-TOLUIDIDE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22F3N5O
InChI InChI=1S/C22H22F3N5O/c1-28-11-13-29(14-12-28)19-7-5-16(6-8-19)20-9-10-26-30(20)21(31)27-18-4-2-3-17(15-18)22(23,24)25/h2-10,15H,11-14H2,1H3,(H,27,31)
InChIKey YYJYVZGLQYRJOT-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 204-206C
Molecular Weight 429.44
Solvent CDCl3; Reference=TMS; Temperature 297K