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4-[(2,4-DICHLOROANILINO)METHYLENE]-1-METHYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE
SpectraBase Compound ID 9KWfo6F5C57
InChI InChI=1S/C12H8Cl2F3N3O/c1-20-11(21)7(10(19-20)12(15,16)17)5-18-9-3-2-6(13)4-8(9)14/h2-5,18H,1H3
InChIKey WLVWPNPQEAPAQA-UHFFFAOYSA-N
Mol Weight 338.12 g/mol
Molecular Formula C12H8Cl2F3N3O
Exact Mass 336.999652 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8zxvAudVM7s
Name 4-[(2,4-DICHLOROANILINO)METHYLENE]-1-METHYL-3-(TRIFLUOROMETHYL)-2-PYRAZOLIN-5-ONE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8Cl2F3N3O
InChI InChI=1S/C12H8Cl2F3N3O/c1-20-11(21)7(10(19-20)12(15,16)17)5-18-9-3-2-6(13)4-8(9)14/h2-5,18H,1H3
InChIKey WLVWPNPQEAPAQA-UHFFFAOYSA-N
Melting Point 171-173C
Molecular Weight 338.12
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 2-PYRAZOLIN-5-ONE, 4-//2,4-DICHLOROANILINO/METHYLENE/-1-METHYL-3-/TRIFLUOROMETHYL/-,