Systematic / IUPAC Name: (4Z)-4-[(Dimethylamino)methylene]-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
ID: Reference3906
Other Names: 4-[(Dimethylamino)methylene]-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Formula: C13H12F3N3O
4-[(Dimethylamino)methylidene]-1-phenyl-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 117 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 2/17/2016 1:29:08 PM |
InChI | InChI=1S/C13H12F3N3O/c1-18(2)8-10-11(13(14,15)16)17-19(12(10)20)9-6-4-3-5-7-9/h3-8H,1-2H3/b10-8- |
InChI Key | ZKBSLPLEAZYVLF-NTMALXAHSA-N |
Canonical SMILES | CN(C)C=C1C(=NN(C1=O)C2=CC=CC=C2)C(F)(F)F |
CAS | |
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Other Names | 4-[(Dimethylamino)methylene]-2-phenyl-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one |