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4-[3-(4-BROMOLPHENYL)-5-HYDROXY-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-7-CHLOROQUINOLINE
SpectraBase Compound ID 4c1CeWE4UdT
InChI InChI=1S/C19H12BrClF3N3O/c20-12-3-1-11(2-4-12)16-10-18(28,19(22,23)24)27(26-16)17-7-8-25-15-9-13(21)5-6-14(15)17/h1-9,28H,10H2
InChIKey HIIZYULEWVDCPP-UHFFFAOYSA-N
Mol Weight 470.68 g/mol
Molecular Formula C19H12BrClF3N3O
Exact Mass 468.980437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bag7vUbWLdd
Name 4-[5'-Hydroxy-3'-(p-bromophenyl)-5'-(trifluoromethyl)-4',5'-dihydro-1H-pyrazol-1'-yl]-7-chloroquinoline
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Formula C19H12BrClF3N3O
InChI InChI=1S/C19H12BrClF3N3O/c20-12-3-1-11(2-4-12)16-10-18(28,19(22,23)24)27(26-16)17-7-8-25-15-9-13(21)5-6-14(15)17/h1-9,28H,10H2
InChIKey HIIZYULEWVDCPP-UHFFFAOYSA-N
Molecular Weight 470.677 g/mol
SMILES OC1(N(N=C(C1)c1ccc(cc1)Br)c1c2c(cc(cc2)Cl)ncc1)C(F)(F)F
SPLASH splash10-0pb9-0101900000-237e899ad5586776c502
Source of Spectrum AJ-42-1058-2
Synonyms 3-(4-bromophenyl)-1-(7-chloro-4-quinolinyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol 5-(4-bromophenyl)-2-(7-chloro-4-quinolinyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 5-(4-bromophenyl)-2-(7-chloroquinolin-4-yl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 5-(4-bromophenyl)-2-(7-chloro-4-quinolyl)-3-(trifluoromethyl)-4H-pyrazol-3-ol 5-(4-bromophenyl)-2-(7-chloranylquinolin-4-yl)-3-(trifluoromethyl)-4H-pyrazol-3-ol
Wiley ID 1568152