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5,5-Dimethyl-2-[3,5-bis(trifluoromethyl)phenyl]-1,3,2-dioxaborinane
SpectraBase Compound ID 88DiPaLdKZd
InChI InChI=1S/C13H13BF6O2/c1-11(2)6-21-14(22-7-11)10-4-8(12(15,16)17)3-9(5-10)13(18,19)20/h3-5H,6-7H2,1-2H3
InChIKey RWKOPQLIGPEOIS-UHFFFAOYSA-N
Mol Weight 326.0 g/mol
Molecular Formula C13H13BF6O2
Exact Mass 326.091279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJqyUzEoOcR
Name 5,5-Dimethyl-2-[3,5-bis(trifluoromethyl)phenyl]-1,3,2-dioxaborinane
Alternate Name(s) 2-(3,5-bis(trifluoromethyl)phenyl)-5,5-dimethyl-1,3,2-dioxaborinane
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Formula C13H13BF6O2
InChI InChI=1S/C13H13BF6O2/c1-11(2)6-21-14(22-7-11)10-4-8(12(15,16)17)3-9(5-10)13(18,19)20/h3-5H,6-7H2,1-2H3
InChIKey RWKOPQLIGPEOIS-UHFFFAOYSA-N
Molecular Weight 326.045 g/mol
SMILES C1OB(OCC1(C)C)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
SPLASH splash10-057i-0049000000-ee6dc760b438e8201534
Source of Spectrum AG-788-14-3o
Wiley ID 1804504