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4-((5-bromo-2-fluoro-3-(triethylsilyl)phenyl)(hydroxy)methyl)benzonitrile
SpectraBase Compound ID 9ExUpShbidF
InChI InChI=1S/C20H23BrFNOSi/c1-4-25(5-2,6-3)18-12-16(21)11-17(19(18)22)20(24)15-9-7-14(13-23)8-10-15/h7-12,20,24H,4-6H2,1-3H3
InChIKey MXQJZQKIYBRXQU-UHFFFAOYSA-N
Mol Weight 420.4 g/mol
Molecular Formula C20H23BrFNOSi
Exact Mass 419.071632 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bayco1s3vBi
Name 4-((5-bromo-2-fluoro-3-(triethylsilyl)phenyl)(hydroxy)methyl)benzonitrile
Appearance Colorless oil
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Formula C20H23BrFNOSi
InChI InChI=1S/C20H23BrFNOSi/c1-4-25(5-2,6-3)18-12-16(21)11-17(19(18)22)20(24)15-9-7-14(13-23)8-10-15/h7-12,20,24H,4-6H2,1-3H3
InChIKey MXQJZQKIYBRXQU-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812742
Molecular Weight 420.397 g/mol
Reported Formula C20H23(79)BrFNO(28)Si
SMILES OC(c1c(c(cc(c1)Br)[Si](CC)(CC)CC)F)c1ccc(cc1)C#N
SPLASH splash10-057i-6290000000-c8a34d9d6d6994282b30
Source of Spectrum ACI-58-SM55-6d
Wiley ID 1840684