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5,5-Dimethyl-2-(4-(trifluoromethyl)phenyl)-1,3,2-dioxaborinane
SpectraBase Compound ID B9q9gvqU0J8
InChI InChI=1S/C12H14BF3O2/c1-11(2)7-17-13(18-8-11)10-5-3-9(4-6-10)12(14,15)16/h3-6H,7-8H2,1-2H3
InChIKey RHRLRPXJTDDILM-UHFFFAOYSA-N
Mol Weight 258.0 g/mol
Molecular Formula C12H14BF3O2
Exact Mass 258.103894 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pZ5WU03S13
Name 5,5-Dimethyl-2-(4-(trifluoromethyl)phenyl)-1,3,2-dioxaborinane
Appearance White solid
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Exact Mass 258.103894348 u
Formula C12H14BF3O2
InChI InChI=1S/C12H14BF3O2/c1-11(2)7-17-13(18-8-11)10-5-3-9(4-6-10)12(14,15)16/h3-6H,7-8H2,1-2H3
InChIKey RHRLRPXJTDDILM-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201603068
Molecular Weight 258.047 g/mol
Quality 82
SMILES C=1C(C(F)(F)F)=CC=C(B2OCC(C)(C)CO2)C1
SPLASH splash10-0a4i-9250000000-66393c88c4c584bb13c1
Source of Spectrum ACI-55-SM17-3ia (DOI: 10.1002/anie.201603068)
Wiley ID 1900998