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1-(p-CHLOROPHENYL)-5-PROPYL-alpha,alpha,alpha-TRIFLUOROPYRAZOLE-4-CARBOXY-m-TOLUIDIDE
SpectraBase Compound ID 7KoVgauqBkk
InChI InChI=1S/C20H17ClF3N3O/c1-2-4-18-17(12-25-27(18)16-9-7-14(21)8-10-16)19(28)26-15-6-3-5-13(11-15)20(22,23)24/h3,5-12H,2,4H2,1H3,(H,26,28)
InChIKey MTMNMLSDHIUNRC-UHFFFAOYSA-N
Mol Weight 407.82 g/mol
Molecular Formula C20H17ClF3N3O
Exact Mass 407.101224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9STWCrwY16m
Name 1-(p-CHLOROPHENYL)-5-PROPYL-alpha,alpha,alpha-TRIFLUOROPYRAZOLE-4-CARBOXY-m-TOLUIDIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17ClF3N3O
InChI InChI=1S/C20H17ClF3N3O/c1-2-4-18-17(12-25-27(18)16-9-7-14(21)8-10-16)19(28)26-15-6-3-5-13(11-15)20(22,23)24/h3,5-12H,2,4H2,1H3,(H,26,28)
InChIKey MTMNMLSDHIUNRC-UHFFFAOYSA-N
Molecular Weight 407.83
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PYRAZOLE-4-CARBOXY-M-TOLUIDIDE, 1-/P-CHLOROPHENYL/-5-PROPYL-A,A,A-TRIFLUORO-,