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trans-1-Methyl-4-p-methylphenyl-3-fluoro-3-trifluoromethyl-2-azetidinone
SpectraBase Compound ID FLj8bvzXCTk
InChI InChI=1S/C12H11F4NO/c1-7-3-5-8(6-4-7)9-11(13,12(14,15)16)10(18)17(9)2/h3-6,9H,1-2H3/t9-,11+/m1/s1
InChIKey MYZCPZWAAJAGKL-KOLCDFICSA-N
Mol Weight 261.22 g/mol
Molecular Formula C12H11F4NO
Exact Mass 261.077677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrEVR9jOtY5
Name trans-1-Methyl-4-p-methylphenyl-3-fluoro-3-trifluoromethyl-2-azetidinone
Alternate Name(s) (3S,4R)-3-fluoro-1-methyl-4-(4-methylphenyl)-3-(trifluoromethyl)-2-azetidinone (3S,4R)-3-fluoro-1-methyl-4-(4-methylphenyl)-3-(trifluoromethyl)azetidin-2-one (3S,4R)-3-fluoranyl-1-methyl-4-(4-methylphenyl)-3-(trifluoromethyl)azetidin-2-one
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Formula C12H11F4NO
InChI InChI=1S/C12H11F4NO/c1-7-3-5-8(6-4-7)9-11(13,12(14,15)16)10(18)17(9)2/h3-6,9H,1-2H3/t9-,11+/m1/s1
InChIKey MYZCPZWAAJAGKL-KOLCDFICSA-N
Molecular Weight 261.220 g/mol
SMILES [C@]1(C(=O)N([C@@]1(c1ccc(cc1)C)[H])C)(C(F)(F)F)F
SPLASH splash10-0udj-0290000000-1082af264090227c14c3
Source of Spectrum J-73-5440-4a'
Wiley ID 1668489