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(3-Bromo-phenyl)-(5-hydroxy-3,5-bis-trifluoromethyl-4,5-dihydro-pyrazol-1-yl)-methanone
SpectraBase Compound ID AtkPxdhx8aT
InChI InChI=1S/C12H7BrF6N2O2/c13-7-3-1-2-6(4-7)9(22)21-10(23,12(17,18)19)5-8(20-21)11(14,15)16/h1-4,23H,5H2
InChIKey PRSXTZUCPXNACB-UHFFFAOYSA-N
Mol Weight 405.09 g/mol
Molecular Formula C12H7BrF6N2O2
Exact Mass 403.959509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdWWh7dxoZq
Name (3-Bromo-phenyl)-(5-hydroxy-3,5-bis-trifluoromethyl-4,5-dihydro-pyrazol-1-yl)-methanone
Alternate Name(s) (3-bromophenyl)-[5-hydroxy-3,5-bis(trifluoromethyl)-2-pyrazolin-1-yl]methanone (3-bromophenyl)-[5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]methanone (3-bromophenyl)-[5-oxidanyl-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]methanone
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Formula C12H7BrF6N2O2
InChI InChI=1S/C12H7BrF6N2O2/c13-7-3-1-2-6(4-7)9(22)21-10(23,12(17,18)19)5-8(20-21)11(14,15)16/h1-4,23H,5H2
InChIKey PRSXTZUCPXNACB-UHFFFAOYSA-N
Molecular Weight 405.094 g/mol
SMILES OC1(N(N=C(C(F)(F)F)C1)C(c1cc(Br)ccc1)=O)C(F)(F)F
SPLASH splash10-0569-6900000000-2c96b96280ac262d6df8
Wiley ID 1465776