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chloromethyl-dimethyl-[(1R)-2,2,2-trifluoro-1-[(4-fluorophenyl)methyl]-1-methyl-ethoxy]silane
SpectraBase Compound ID 5NvI7YqrmRW
InChI InChI=1S/C13H17ClF4OSi/c1-12(13(16,17)18,19-20(2,3)9-14)8-10-4-6-11(15)7-5-10/h4-7H,8-9H2,1-3H3/t12-/m1/s1
InChIKey WNZHGKJKNCXSHX-GFCCVEGCSA-N
Mol Weight 328.81 g/mol
Molecular Formula C13H17ClF4OSi
Exact Mass 328.067332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 578LmUYV7Ri
Name chloromethyl-dimethyl-[(1R)-2,2,2-trifluoro-1-[(4-fluorophenyl)methyl]-1-methyl-ethoxy]silane
Appearance Colorless oil
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Exact Mass 328.067332053 u
Formula C13H17ClF4OSi
InChI InChI=1S/C13H17ClF4OSi/c1-12(13(16,17)18,19-20(2,3)9-14)8-10-4-6-11(15)7-5-10/h4-7H,8-9H2,1-3H3/t12-/m1/s1
InChIKey WNZHGKJKNCXSHX-GFCCVEGCSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208861
Molecular Weight 328.810 g/mol
Optical Rotation [a]D20 = -10.2 (c = 0.50, CHCl3)
Quality 98
Reported Formula C13H17OF4Si(35)Cl
SMILES C1(=CC=C(C=C1)C[C@@](O[Si](CCl)(C)C)(C(F)(F)F)C)F
SPLASH splash10-0a4i-1920000000-b22e32395822f776d4ed
Sample Comments 71% ee
Source of Spectrum ACI-61-SM30-13t (DOI: 10.1002/anie.202208861)
Wiley ID 1899451