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p-{{{5-OXO-1-[p-(TRIFLUOROMETHOXY)PHENYL]-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-4-YLIDENE}METHYL}AMINO}BENZOIC ACID, METHYL ESTER

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

p-{{{5-OXO-1-[p-(TRIFLUOROMETHOXY)PHENYL]-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-4-YLIDENE}METHYL}AMINO}BENZOIC ACID, METHYL ESTER
SpectraBase Compound ID 5iFNLyjitG5
InChI InChI=1S/C20H13F6N3O4/c1-32-18(31)11-2-4-12(5-3-11)27-10-15-16(19(21,22)23)28-29(17(15)30)13-6-8-14(9-7-13)33-20(24,25)26/h2-10,27H,1H3
InChIKey UQUNWYNORYLNHO-UHFFFAOYSA-N
Mol Weight 473.33 g/mol
Molecular Formula C20H13F6N3O4
Exact Mass 473.081025 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1a6jSNPz6Nq
Name p-{{{5-OXO-1-[p-(TRIFLUOROMETHOXY)PHENYL]-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-4-YLIDENE}METHYL}AMINO}BENZOIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13F6N3O4
InChI InChI=1S/C20H13F6N3O4/c1-32-18(31)11-2-4-12(5-3-11)27-10-15-16(19(21,22)23)28-29(17(15)30)13-6-8-14(9-7-13)33-20(24,25)26/h2-10,27H,1H3
InChIKey UQUNWYNORYLNHO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 184-187C
Molecular Weight 473.33
Solvent CDCl3; Reference=TMS; Temperature 297K