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4-[5-HYDROXY-3-(4-NITROPHENYL)-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-7-CHLOROQUINOLINE
SpectraBase Compound ID 3LWgHyXvErB
InChI InChI=1S/C19H12ClF3N4O3/c20-12-3-6-14-15(9-12)24-8-7-17(14)26-18(28,19(21,22)23)10-16(25-26)11-1-4-13(5-2-11)27(29)30/h1-9,28H,10H2
InChIKey SBKUKULJKWRRLF-UHFFFAOYSA-N
Mol Weight 436.78 g/mol
Molecular Formula C19H12ClF3N4O3
Exact Mass 436.055002 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8U3VniN0AT
Name 4-[5'-Hydroxy-3'-(p-nitrophenyl)-5'-(trifluoromethyl)-4',5'-dihydro-1H-pyrazol-1'-yl]-7-chloroquinoline
Alternate Name(s) 1-(7-Chloro-4-quinolinyl)-3-(4-nitrophenyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol 2-(7-Chloro-4-quinolinyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 2-(7-Chloroquinolin-4-yl)-5-(4-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 2-(7-Chloro-4-quinolyl)-5-(4-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 2-(7-Chloranylquinolin-4-yl)-5-(4-nitrophenyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol
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Formula C19H12ClF3N4O3
InChI InChI=1S/C19H12ClF3N4O3/c20-12-3-6-14-15(9-12)24-8-7-17(14)26-18(28,19(21,22)23)10-16(25-26)11-1-4-13(5-2-11)27(29)30/h1-9,28H,10H2
InChIKey SBKUKULJKWRRLF-UHFFFAOYSA-N
Molecular Weight 436.778 g/mol
SMILES OC1(N(N=C(C1)c1ccc(N(=O)=O)cc1)c1c2c(cc(cc2)Cl)ncc1)C(F)(F)F
SPLASH splash10-014j-0103900000-7e8f0141a72172425bfb
Source of Spectrum AJ-42-1059-2
Wiley ID 1568150