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4-bromo-N-[(1S)-1-methyl-1-phenyl-2-trimethylsilyl-penta-2,3-dienyl]benzenesulfonamide
SpectraBase Compound ID Jdys0y3dFev
InChI InChI=1S/C21H26BrNO2SSi/c1-6-10-20(27(3,4)5)21(2,17-11-8-7-9-12-17)23-26(24,25)19-15-13-18(22)14-16-19/h6-9,11-16,23H,1-5H3/t10?,21-/m0/s1
InChIKey NUBRENMAGLRAGS-MNKSETBFSA-N
Mol Weight 464.49 g/mol
Molecular Formula C21H26BrNO2SSi
Exact Mass 463.06369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yT2D1s6Ccp
Name 4-bromo-N-[(1S)-1-methyl-1-phenyl-2-trimethylsilyl-penta-2,3-dienyl]benzenesulfonamide
Appearance Colorless solid
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Formula C21H26BrNO2SSi
InChI InChI=1S/C21H26BrNO2SSi/c1-6-10-20(27(3,4)5)21(2,17-11-8-7-9-12-17)23-26(24,25)19-15-13-18(22)14-16-19/h6-9,11-16,23H,1-5H3/t10?,21-/m0/s1
InChIKey NUBRENMAGLRAGS-MNKSETBFSA-N
Ionization Type EI
Molecular Weight 464.493 g/mol
Optical Rotation [a]D20 = 61.9 (c = 1.0, CHCl3)
Reported Formula C21H26NO2SiSBr
SMILES N([C@@](c1ccccc1)(C(=C=CC)[Si](C)(C)C)C)S(c1ccc(cc1)Br)(=O)=O
SPLASH splash10-059f-2429000000-3b1c5e6a0f20ec3b18c2
Sample Comments 97% ee
Source of Spectrum CN113956276A
Wiley ID 1882364